[2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl] 3-[(3-methylphenyl)methoxy]benzoate

Systemtic Name: [2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxidanylidene-ethyl] 3-[(3-methylphenyl)methoxy]benzoate Openeye Name: [2-[(4-methylthiazol-2-yl)amino]-2-oxo-ethyl] 3-(m-tolylmethoxy)benzoate CAS Name: 3-[(3-methylphenyl)methoxy]benzoic acid [2-[(4-methyl-2-thiazolyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(4-methyl-1,3-thiazol-2-yl)amino]-2-oxoethyl] 3-[(3-methylphenyl)methoxy]benzoate Traditional Name: 3-(3-methylbenzyl)oxybenzoic acid [2-keto-2-[(4-methylthiazol-2-yl)amino]ethyl] ester Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC2=CC=CC(=C2)C(=O)OCC(=O)NC3=NC(=CS3)C

Isomeric SMILES

CC1=CC(=CC=C1)COC2=CC=CC(=C2)C(=O)OCC(=O)NC3=NC(=CS3)C

InChI

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