[2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl] 2-(4-methoxyphenyl)-1,3-thiazole-4-carboxylate

Systemtic Name: [2-[(2-methylphenyl)methylamino]-2-oxidanylidene-ethyl] 2-(4-methoxyphenyl)-1,3-thiazole-4-carboxylate Openeye Name: [2-(o-tolylmethylamino)-2-oxo-ethyl] 2-(4-methoxyphenyl)thiazole-4-carboxylate CAS Name: 2-(4-methoxyphenyl)-4-thiazolecarboxylic acid [2-[(2-methylphenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(2-methylphenyl)methylamino]-2-oxoethyl] 2-(4-methoxyphenyl)-1,3-thiazole-4-carboxylate Traditional Name: 2-(4-methoxyphenyl)thiazole-4-carboxylic acid [2-keto-2-[(2-methylbenzyl)amino]ethyl] ester Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CNC(=O)COC(=O)C2=CSC(=N2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=CC=C1CNC(=O)COC(=O)C2=CSC(=N2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C21H20N2O4S/c1-14-5-3-4-6-16(14)11-22-19(24)12-27-21(25)18-13-28-20(23-18)15-7-9-17(26-2)10-8-15/h3-10,13H,11-12H2,1-2H3,(H,22,24)