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

Systemtic Name: 4-[(E)-[3-(2-methylphenyl)-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoic acid Openeye Name: 4-[(E)-[3-(o-tolyl)-4-oxo-2-thioxo-thiazolidin-5-ylidene]methyl]benzoic acid CAS Name: 4-[(E)-[3-(2-methylphenyl)-4-oxo-2-sulfanylidene-5-thiazolidinylidene]methyl]benzoic acid IUPAC Name: 4-[(E)-[3-(2-methylphenyl)-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoic acid Traditional Name: 4-[(E)-[4-keto-3-(o-tolyl)-2-thioxo-thiazolidin-5-ylidene]methyl]benzoic acid Formula: C18H13NO3S2 MolecularWeight: 355.43072

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C(=O)C(=CC3=CC=C(C=C3)C(=O)O)SC2=S

Isomeric SMILES

CC1=CC=CC=C1N2C(=O)/C(=C\C3=CC=C(C=C3)C(=O)O)/SC2=S

InChI

InChI=1S/C18H13NO3S2/c1-11-4-2-3-5-14(11)19-16(20)15(24-18(19)23)10-12-6-8-13(9-7-12)17(21)22/h2-10H,1H3,(H,21,22)/b15-10+