1-(4-chlorophenyl)-N-[4-(4-methylphenyl)carbonylphenyl]-1,2,4-triazole-3-carboxamide

Systemtic Name: 1-(4-chlorophenyl)-N-[4-(4-methylphenyl)carbonylphenyl]-1,2,4-triazole-3-carboxamide Openeye Name: 1-(4-chlorophenyl)-N-[4-(4-methylbenzoyl)phenyl]-1,2,4-triazole-3-carboxamide CAS Name: 1-(4-chlorophenyl)-N-[4-[(4-methylphenyl)-oxomethyl]phenyl]-1,2,4-triazole-3-carboxamide IUPAC Name: 1-(4-chlorophenyl)-N-[4-(4-methylbenzoyl)phenyl]-1,2,4-triazole-3-carboxamide Traditional Name: 1-(4-chlorophenyl)-N-(4-p-toluoylphenyl)-1,2,4-triazole-3-carboxamide Formula: C23H17ClN4O2 MolecularWeight: 416.85968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)NC(=O)C3=NN(C=N3)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)NC(=O)C3=NN(C=N3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H17ClN4O2/c1-15-2-4-16(5-3-15)21(29)17-6-10-19(11-7-17)26-23(30)22-25-14-28(27-22)20-12-8-18(24)9-13-20/h2-14H,1H3,(H,26,30)