methyl 3-[[1-(4-chlorophenyl)-5-methyl-1,2,4-triazol-3-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl 3-[[1-(4-chlorophenyl)-5-methyl-1,2,4-triazol-3-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl 3-[[1-(4-chlorophenyl)-5-methyl-1,2,4-triazole-3-carbonyl]amino]-3-phenyl-propanoate CAS Name: 3-[[[1-(4-chlorophenyl)-5-methyl-1,2,4-triazol-3-yl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-[[1-(4-chlorophenyl)-5-methyl-1,2,4-triazole-3-carbonyl]amino]-3-phenylpropanoate Traditional Name: 3-[[1-(4-chlorophenyl)-5-methyl-1,2,4-triazole-3-carbonyl]amino]-3-phenyl-propionic acid methyl ester Formula: C20H19ClN4O3 MolecularWeight: 398.84286

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1C2=CC=C(C=C2)Cl)C(=O)NC(CC(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=NN1C2=CC=C(C=C2)Cl)C(=O)NC(CC(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C20H19ClN4O3/c1-13-22-19(24-25(13)16-10-8-15(21)9-11-16)20(27)23-17(12-18(26)28-2)14-6-4-3-5-7-14/h3-11,17H,12H2,1-2H3,(H,23,27)