methyl 2-[[(3-methylphenyl)carbamoyl-propan-2-yl-amino]methyl]-1,3-thiazole-4-carboxylate

Systemtic Name: methyl 2-[[(3-methylphenyl)carbamoyl-propan-2-yl-amino]methyl]-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[[isopropyl(m-tolylcarbamoyl)amino]methyl]thiazole-4-carboxylate CAS Name: 2-[[[(3-methylanilino)-oxomethyl]-propan-2-ylamino]methyl]-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(3-methylphenyl)carbamoyl-propan-2-ylamino]methyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[isopropyl(m-tolylcarbamoyl)amino]methyl]thiazole-4-carboxylic acid methyl ester Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)N(CC2=NC(=CS2)C(=O)OC)C(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)N(CC2=NC(=CS2)C(=O)OC)C(C)C

InChI

InChI=1S/C17H21N3O3S/c1-11(2)20(9-15-19-14(10-24-15)16(21)23-4)17(22)18-13-7-5-6-12(3)8-13/h5-8,10-11H,9H2,1-4H3,(H,18,22)