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

Systemtic Name: 4-[(E)-[2-(4-ethylphenyl)imino-3-methyl-4-oxidanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoic acid Openeye Name: 4-[(E)-[2-(4-ethylphenyl)imino-3-methyl-4-oxo-thiazolidin-5-ylidene]methyl]benzoic acid CAS Name: 4-[(E)-[2-(4-ethylphenyl)imino-3-methyl-4-oxo-5-thiazolidinylidene]methyl]benzoic acid IUPAC Name: 4-[(E)-[2-(4-ethylphenyl)imino-3-methyl-4-oxo-1,3-thiazolidin-5-ylidene]methyl]benzoic acid Traditional Name: 4-[(E)-[2-(4-ethylphenyl)imino-4-keto-3-methyl-thiazolidin-5-ylidene]methyl]benzoic acid Formula: C20H18N2O3S MolecularWeight: 366.43352

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N=C2N(C(=O)C(=CC3=CC=C(C=C3)C(=O)O)S2)C

Isomeric SMILES

CCC1=CC=C(C=C1)N=C2N(C(=O)/C(=C\C3=CC=C(C=C3)C(=O)O)/S2)C

InChI

InChI=1S/C20H18N2O3S/c1-3-13-6-10-16(11-7-13)21-20-22(2)18(23)17(26-20)12-14-4-8-15(9-5-14)19(24)25/h4-12H,3H2,1-2H3,(H,24,25)/b17-12+,21-20?