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Depiction
Precursor
2-[2-[(1-Ethylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazol-3-yl]acetic acid
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3)CC(=O)O
7 steps
Depiction
Dead-End Product
Succinyl-carboxylic acid
C(CCC(=O)C(=O)O)(=O)C(O)=O
Depiction
Upstream Precursor
4-[(2E)-2-[(1-ethylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazol-3-yl]butane-1-sulfonic acid
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3)CCCCS(=O)(=O)O
Depth 3
Depiction
Product
2-[2-[(1-Ethylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazol-3-yl]acetic acid
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3)CC(=O)O
Depiction
Upstream Precursor
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3=O)CC(=O)O
Depth 1
Depiction
Product
2-[2-[(1-Ethylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazol-3-yl]acetic acid
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3)CC(=O)O
Depiction
Upstream Precursor
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3)CCCC(=O)O
Depth 1
Depiction
Product
2-[2-[(1-Ethylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazol-3-yl]acetic acid
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3)CC(=O)O
Depiction
Upstream Precursor
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3=O)CCCC=O
Depth 3
Depiction
Product
2-[2-[(1-Ethylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazol-3-yl]acetic acid
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3)CC(=O)O
Depiction
Upstream Precursor
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3)CCCC=O
Depth 2
Depiction
Product
2-[2-[(1-Ethylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazol-3-yl]acetic acid
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3)CC(=O)O
Depiction
Upstream Precursor
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3[N+](C4=CC=CC=C4S3=O)(CC(=O)O)[O-]
Depth 2
Depiction
Product
2-[2-[(1-Ethylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazol-3-yl]acetic acid
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3)CC(=O)O
Depiction
Upstream Precursor
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4[S+]3Cl)CC(=O)O
Depth 2
Depiction
Product
2-[2-[(1-Ethylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazol-3-yl]acetic acid
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3)CC(=O)O
Depiction
Upstream Precursor
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3(=O)=O)CC(=O)O
Depth 2
Depiction
Product
2-[2-[(1-Ethylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazol-3-yl]acetic acid
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3)CC(=O)O
Depiction
Upstream Precursor
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3[N+](C4=CC=CC=C4S3)(CC(=O)O)[O-]
Depth 1
Depiction
Product
2-[2-[(1-Ethylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazol-3-yl]acetic acid
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3)CC(=O)O
Depiction
Upstream Precursor
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3[N+](C4=CC=CC=C4[S+]3Cl)(CC(=O)O)[O-]
Depth 3
Depiction
Product
2-[2-[(1-Ethylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazol-3-yl]acetic acid
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3)CC(=O)O
Depiction
Precursor
2-[2-[(1-Ethylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazol-3-yl]acetic acid
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3)CC(=O)O
Depth 3
Depiction
Downstream Successor
2-Hydroxyhexa-2,4-diendioic acid
C(=CC=CC(=O)O)(C(O)=O)O
Depiction
Precursor
2-[2-[(1-Ethylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazol-3-yl]acetic acid
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3)CC(=O)O
Depth 3
Depiction
Downstream Successor
2,4-Hexadienedioic acid, (2Z,4Z)-
C(C=CC=CC(=O)O)(O)=O
Depiction
Precursor
2-[2-[(1-Ethylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazol-3-yl]acetic acid
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3)CC(=O)O
Depth 3
Depiction
Downstream Successor
3-Sulfanylbenzene-1,2-diol
OC1=C(C(=CC=C1)S)O
Depiction
Precursor
2-[2-[(1-Ethylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazol-3-yl]acetic acid
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3)CC(=O)O
Depth 2
Depiction
Downstream Successor
CC[N+]1=C(C=CC(C=CC(O)=O)=C1C(=O)O)C=C2NC3=CC=CC=C3S2
Depiction
Precursor
2-[2-[(1-Ethylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazol-3-yl]acetic acid
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3)CC(=O)O
Depth 2
Depiction
Downstream Successor
[NH+]1=C(C=CC2=CC=CC=C21)C=C3NC4=CC=CC=C4S3
Depiction
Precursor
2-[2-[(1-Ethylquinolin-1-ium-2-yl)methylidene]-1,3-benzothiazol-3-yl]acetic acid
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3N(C4=CC=CC=C4S3)CC(=O)O
Depth 1
Depiction
Downstream Successor
CC[N+]1=C(C=CC2=CC=CC=C21)C=C3NC4=CC=CC=C4S3
No Original Precursors

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