Graphs show a maximum of 100 compounds. Use downloads for complete results.
Depiction
Precursor
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
11 steps
Depiction
Dead-End Product
OKKJLVBELUTLKV-UHFFFAOYSA-N
Methanol
CO
Depiction
Precursor
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
3 steps
Depiction
Dead-End Product
BDAGIHXWWSANSR-UHFFFAOYSA-N
Formic Acid
OC=O
Depiction
Precursor
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
5 steps
Depiction
Dead-End Product
BVKZGUZCCUSVTD-UHFFFAOYSA-N
Carbonic Acid
C(=O)(O)O
Depiction
Precursor
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
4 steps
Depiction
Dead-End Product
MUBZPKHOEPUJKR-UHFFFAOYSA-N
Oxalic Acid
C(=O)(C(O)=O)O
Depiction
Precursor
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
11 steps
Depiction
Dead-End Product
CKFGINPQOCXMAZ-UHFFFAOYSA-N
Methanediol
C(O)O
Depiction
Precursor
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
11 steps
Depiction
Dead-End Product
VNWKTOKETHGBQD-UHFFFAOYSA-N
Methane
C
Depiction
Precursor
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
8 steps
Depiction
Dead-End Product
HEPCJCVNHBXRBO-UHFFFAOYSA-N
Succinyl-carboxylic acid
C(CCC(=O)C(=O)O)(=O)C(O)=O
Depiction
Precursor
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
12 steps
Depiction
Dead-End Product
RBBOAWUPWQANPY-UHFFFAOYSA-N
1,2,4-Butantriol Alkohol
C(CC(C(O)O)O)O
Depiction
Precursor
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
12 steps
Depiction
Dead-End Product
YPOPNBBFFROUGR-UHFFFAOYSA-N
But-1-ene-1,1,4-triol
C(CC=C(O)O)O
Depiction
Precursor
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
5 steps
Depiction
Dead-End Product
LJDZFAPLPVPTBD-UHFFFAOYSA-M
CID 22568690
C([N+](=O)[O-])([O-])=O

Previewing top 10 entries. If you want the full results, please use the download button above.

Depiction
Upstream Precursor
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
Abiotic
Depiction
Product
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
Depiction
Upstream Precursor
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
Abiotic
Depiction
Product
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
Depiction
Upstream Precursor
KWMBPFRZHHZVLC-UHFFFAOYSA-N
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
Abiotic
Depiction
Product
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
Depiction
Upstream Precursor
QOWWSRREQYBMFB-UHFFFAOYSA-N
CCCCC(CC)COC(=O)CS(C1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN…
Abiotic
Depiction
Product
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
Depiction
Upstream Precursor
GXOMXAUJAHWYLL-UHFFFAOYSA-N
CCCCC(CC)COC(=O)CS(C1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN…
Abiotic
Depiction
Product
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
Depiction
Upstream Precursor
KWMBPFRZHHZVLC-UHFFFAOYSA-N
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
Abiotic
Depiction
Product
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
Depiction
Upstream Precursor
QOWWSRREQYBMFB-UHFFFAOYSA-N
CCCCC(CC)COC(=O)CS(C1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN…
Abiotic
Depiction
Product
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
Depiction
Upstream Precursor
AHEKCPMROMVVTD-UHFFFAOYSA-O
CCCCC(CC)COC(=O)C[S+](C1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3…
Abiotic
Depiction
Product
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
Depiction
Upstream Precursor
XBGISOLDTKIZPO-UHFFFAOYSA-O
CCCCC(CC)COC(=O)CS(C1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN…
Abiotic
Depiction
Product
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
Depiction
Upstream Precursor
AIQUMDHBYSTURT-UHFFFAOYSA-N
CCCCC(CC)COC(=O)CS(C1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN…
Abiotic
Depiction
Product
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…

Previewing top 10 entries. If you want the full results, please use the download button above.

Depiction
Precursor
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
Abiotic
Depiction
Downstream Successor
YIWUKEYIRIRTPP-UHFFFAOYSA-N
2-Ethylhexanol
CCCCC(CC)CO
Depiction
Precursor
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
Abiotic
Depiction
Downstream Successor
YIWUKEYIRIRTPP-UHFFFAOYSA-N
2-Ethylhexanol
CCCCC(CC)CO
Depiction
Precursor
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
PriorBiotransformation
Depiction
Downstream Successor
YIWUKEYIRIRTPP-UHFFFAOYSA-N
2-Ethylhexanol
CCCCC(CC)CO
Depiction
Precursor
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
PriorBiotransformation
Depiction
Downstream Successor
IUGYQRQAERSCNH-UHFFFAOYSA-N
Pivalic acid
C(C(C)(C)C)(O)=O
Depiction
Precursor
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
Abiotic
Depiction
Downstream Successor
IUGYQRQAERSCNH-UHFFFAOYSA-N
Pivalic acid
C(C(C)(C)C)(O)=O
Depiction
Precursor
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
Abiotic
Depiction
Downstream Successor
IUGYQRQAERSCNH-UHFFFAOYSA-N
Pivalic acid
C(C(C)(C)C)(O)=O
Depiction
Precursor
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
PriorBiotransformation
Depiction
Downstream Successor
LGYNIFWIKSEESD-UHFFFAOYSA-N
2-Ethylhexanal
O=CC(CC)CCCC
Depiction
Precursor
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
Abiotic
Depiction
Downstream Successor
LGYNIFWIKSEESD-UHFFFAOYSA-N
2-Ethylhexanal
O=CC(CC)CCCC
Depiction
Precursor
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
Abiotic
Depiction
Downstream Successor
RDFQSFOGKVZWKF-UHFFFAOYSA-N
3-Hydroxy-2,2-dimethylpropionic acid
C(C(CO)(C)C)(=O)O
Depiction
Precursor
UZXFIFIUWRBZDL-UHFFFAOYSA-N
2-ethylhexyl 2-[4-[[4-[6-tert-butyl-7-[4-(2,2-dimethylpropanoylamino)phenyl]sulfanyl-5H-pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]sulfamoyl]-2-nitrophenyl]sulfanylacetate
CCCCC(CC)COC(=O)CSC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)C3=NN4…
Abiotic
Depiction
Downstream Successor
AJKXDPSHWRTFOZ-UHFFFAOYSA-N
2-Ethyl-1,6-hexanediol
CCC(CCCCO)CO

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No Original Precursors

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