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Depiction
Precursor
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
1 step
Depiction
Dead-End Product
Methanol
CO
Depiction
Precursor
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
3 steps
Depiction
Dead-End Product
Formic Acid
OC=O
Depiction
Precursor
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
8 steps
Depiction
Dead-End Product
Carbonic Acid
C(=O)(O)O
Depiction
Precursor
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
7 steps
Depiction
Dead-End Product
Oxalic Acid
C(=O)(C(O)=O)O
Depiction
Precursor
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
12 steps
Depiction
Dead-End Product
Methanediol
C(O)O
Depiction
Precursor
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
12 steps
Depiction
Dead-End Product
Methane
C
Depiction
Precursor
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
11 steps
Depiction
Dead-End Product
Succinyl-carboxylic acid
C(CCC(=O)C(=O)O)(=O)C(O)=O
Depiction
Precursor
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
16 steps
Depiction
Dead-End Product
1,2,4-Butantriol Alkohol
C(CC(C(O)O)O)O
Depiction
Precursor
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
16 steps
Depiction
Dead-End Product
But-1-ene-1,1,4-triol
C(CC=C(O)O)O
Depiction
Precursor
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
12 steps
Depiction
Dead-End Product
CID 22568690
C([N+](=O)[O-])([O-])=O
Depiction
Upstream Precursor
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2=O)CCC3=CC(=C(C=C3)OC)OC)…
Depth 1
Depiction
Product
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
Depiction
Upstream Precursor
CC1=C(C(=O)N(C(=C1C=C2C(=O)[N+](C(=S)S2)(CCC3=CC(=C(C=C3)OC)O…
Depth 1
Depiction
Product
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
Depiction
Upstream Precursor
CC1=C(C(=O)N(C(=C1C=C2C(=O)[N+](C(=S)S2=O)(CCC3=CC(=C(C=C3)OC…
Depth 2
Depiction
Product
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
Depiction
Upstream Precursor
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)[S+]2Cl)CCC3=CC(=C(C=C3)OC)…
Depth 2
Depiction
Product
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
Depiction
Upstream Precursor
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2=O)CCC3=CC(=C(C=C3)OC)OC)…
Depth 2
Depiction
Product
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
Depiction
Upstream Precursor
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)[N…
Depth 1
Depiction
Product
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
Depiction
Upstream Precursor
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2(=O)=O)CCC3=CC(=C(C=C3)OC…
Depth 2
Depiction
Product
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
Depiction
Upstream Precursor
CC1=C(C(=O)N(C(=C1C=C2C(=O)[N+](C(=S)[S+]2Cl)(CCC3=CC(=C(C=C3…
Depth 3
Depiction
Product
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
Depiction
Upstream Precursor
CC1=C(C(=O)N(C(=C1C=C2C(=O)[N+](C(=S)S2)(CCC3=CC(=C(C=C3)OC)O…
Depth 2
Depiction
Product
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
Depiction
Upstream Precursor
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)[S+]2Cl)CCC3=CC(=C(C=C3)OC)…
Depth 3
Depiction
Product
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
Depiction
Precursor
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
Depth 1
Depiction
Downstream Successor
Methanol
CO
Depiction
Precursor
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
Depth 2
Depiction
Downstream Successor
3,4-Dimethoxybenzeneacetaldehyde
C(CC1=CC(=C(C=C1)OC)OC)=O
Depiction
Precursor
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
Depth 1
Depiction
Downstream Successor
3,4-Dimethoxyphenethyl alcohol
C(CC1=CC(=C(C=C1)OC)OC)O
Depiction
Precursor
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
Depth 3
Depiction
Downstream Successor
(3,4-Dimethoxyphenyl)acetic acid
OC(=O)CC1=CC(=C(C=C1)OC)OC
Depiction
Precursor
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
Depth 2
Depiction
Downstream Successor
Homovanillyl alcohol
OC1=C(C=C(C=C1)CCO)OC
Depiction
Precursor
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
Depth 3
Depiction
Downstream Successor
2-(3-Hydroxy-4-methoxyphenyl)acetaldehyde
COC1=C(C=C(C=C1)CC=O)O
Depiction
Precursor
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
Depth 3
Depiction
Downstream Successor
5-(2-Hydroxyethyl)-3-methoxybenzene-1,2-diol
OC1=C(C=C(C=C1O)CCO)OC
Depiction
Precursor
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
Depth 2
Depiction
Downstream Successor
5-(2-Hydroxyethyl)-2-methoxyphenol
COC1=C(C=C(C=C1)CCO)O
Depiction
Precursor
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
Depth 1
Depiction
Downstream Successor
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
Depiction
Precursor
6-(4-Benzylpiperidin-1-yl)-5-[[3-[2-(3,4-dimethoxyphenyl)ethyl]-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]-1,4-dimethyl-2-oxopyridine-3-carbonitrile
CC1=C(C(=O)N(C(=C1C=C2C(=O)N(C(=S)S2)CCC3=CC(=C(C=C3)OC)OC)N4…
Depth 1
Depiction
Downstream Successor
Cc1c(c(=O)n(c(c1C=C2C(=O)NC(=S)S2)N3CCC(CC3)Cc4ccccc4)C)C#N
No Original Precursors

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