[2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] 2-[(4-phenyl-1,3-thiazol-2-yl)carbamoyl]benzoate

Systemtic Name: [2-(3,4-dimethylphenyl)-2-oxidanylidene-ethyl] 2-[(4-phenyl-1,3-thiazol-2-yl)carbamoyl]benzoate Openeye Name: [2-(3,4-dimethylphenyl)-2-oxo-ethyl] 2-[(4-phenylthiazol-2-yl)carbamoyl]benzoate CAS Name: 2-[oxo-[(4-phenyl-2-thiazolyl)amino]methyl]benzoic acid [2-(3,4-dimethylphenyl)-2-oxoethyl] ester IUPAC Name: [2-(3,4-dimethylphenyl)-2-oxoethyl] 2-[(4-phenyl-1,3-thiazol-2-yl)carbamoyl]benzoate Traditional Name: 2-[(4-phenylthiazol-2-yl)carbamoyl]benzoic acid [2-(3,4-dimethylphenyl)-2-keto-ethyl] ester Formula: C27H22N2O4S MolecularWeight: 470.53958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)COC(=O)C2=CC=CC=C2C(=O)NC3=NC(=CS3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)COC(=O)C2=CC=CC=C2C(=O)NC3=NC(=CS3)C4=CC=CC=C4)C

InChI

InChI=1S/C27H22N2O4S/c1-17-12-13-20(14-18(17)2)24(30)15-33-26(32)22-11-7-6-10-21(22)25(31)29-27-28-23(16-34-27)19-8-4-3-5-9-19/h3-14,16H,15H2,1-2H3,(H,28,29,31)