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

Systemtic Name: 2-[(E)-[4-oxidanylidene-3-(2-phenylethanoylamino)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoic acid Openeye Name: 2-[(E)-[4-oxo-3-[(2-phenylacetyl)amino]-2-thioxo-thiazolidin-5-ylidene]methyl]benzoic acid CAS Name: 2-[(E)-[4-oxo-3-[(1-oxo-2-phenylethyl)amino]-2-sulfanylidene-5-thiazolidinylidene]methyl]benzoic acid IUPAC Name: 2-[(E)-[4-oxo-3-[(2-phenylacetyl)amino]-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]benzoic acid Traditional Name: 2-[(E)-[4-keto-3-[(2-phenylacetyl)amino]-2-thioxo-thiazolidin-5-ylidene]methyl]benzoic acid Formula: C19H14N2O4S2 MolecularWeight: 398.45546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NN2C(=O)C(=CC3=CC=CC=C3C(=O)O)SC2=S

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NN2C(=O)/C(=C\C3=CC=CC=C3C(=O)O)/SC2=S

InChI

InChI=1S/C19H14N2O4S2/c22-16(10-12-6-2-1-3-7-12)20-21-17(23)15(27-19(21)26)11-13-8-4-5-9-14(13)18(24)25/h1-9,11H,10H2,(H,20,22)(H,24,25)/b15-11+