methyl 4-[5-methyl-4-oxidanylidene-3-[(2-oxidanyl-2-phenyl-ethanoyl)amino]-1,3-thiazolidin-2-yl]benzoate

Systemtic Name: methyl 4-[5-methyl-4-oxidanylidene-3-[(2-oxidanyl-2-phenyl-ethanoyl)amino]-1,3-thiazolidin-2-yl]benzoate Openeye Name: methyl 4-[3-[(2-hydroxy-2-phenyl-acetyl)amino]-5-methyl-4-oxo-thiazolidin-2-yl]benzoate CAS Name: 4-[3-[(2-hydroxy-1-oxo-2-phenylethyl)amino]-5-methyl-4-oxo-2-thiazolidinyl]benzoic acid methyl ester IUPAC Name: methyl 4-[3-[(2-hydroxy-2-phenylacetyl)amino]-5-methyl-4-oxo-1,3-thiazolidin-2-yl]benzoate Traditional Name: 4-[4-keto-3-(mandeloylamino)-5-methyl-thiazolidin-2-yl]benzoic acid methyl ester Formula: C20H20N2O5S MolecularWeight: 400.4482

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C(S1)C2=CC=C(C=C2)C(=O)OC)NC(=O)C(C3=CC=CC=C3)O

Isomeric SMILES

CC1C(=O)N(C(S1)C2=CC=C(C=C2)C(=O)OC)NC(=O)C(C3=CC=CC=C3)O

InChI

InChI=1S/C20H20N2O5S/c1-12-18(25)22(21-17(24)16(23)13-6-4-3-5-7-13)19(28-12)14-8-10-15(11-9-14)20(26)27-2/h3-12,16,19,23H,1-2H3,(H,21,24)