methyl 3-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl 3-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl 3-phenyl-3-[[2-(p-tolyl)thiazole-4-carbonyl]amino]propanoate CAS Name: 3-[[[2-(4-methylphenyl)-4-thiazolyl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-[[2-(4-methylphenyl)-1,3-thiazole-4-carbonyl]amino]-3-phenylpropanoate Traditional Name: 3-phenyl-3-[[2-(p-tolyl)thiazole-4-carbonyl]amino]propionic acid methyl ester Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CS2)C(=O)NC(CC(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CS2)C(=O)NC(CC(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C21H20N2O3S/c1-14-8-10-16(11-9-14)21-23-18(13-27-21)20(25)22-17(12-19(24)26-2)15-6-4-3-5-7-15/h3-11,13,17H,12H2,1-2H3,(H,22,25)