4-[(E)-(4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzoic acid

Systemtic Name: 4-[(E)-(4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzoic acid Openeye Name: 4-[(E)-(3-allyl-4-oxo-2-thioxo-thiazolidin-5-ylidene)methyl]benzoic acid CAS Name: 4-[(E)-(4-oxo-3-prop-2-enyl-2-sulfanylidene-5-thiazolidinylidene)methyl]benzoic acid IUPAC Name: 4-[(E)-(4-oxo-3-prop-2-enyl-2-sulfanylidene-1,3-thiazolidin-5-ylidene)methyl]benzoic acid Traditional Name: 4-[(E)-(3-allyl-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]benzoic acid Formula: C14H11NO3S2 MolecularWeight: 305.37204

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C(=CC2=CC=C(C=C2)C(=O)O)SC1=S

Isomeric SMILES

C=CCN1C(=O)/C(=C\C2=CC=C(C=C2)C(=O)O)/SC1=S

InChI

InChI=1S/C14H11NO3S2/c1-2-7-15-12(16)11(20-14(15)19)8-9-3-5-10(6-4-9)13(17)18/h2-6,8H,1,7H2,(H,17,18)/b11-8+