5-azanyl-1-[[4-(4-chlorophenyl)carbonylphenyl]methyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 5-azanyl-1-[[4-(4-chlorophenyl)carbonylphenyl]methyl]-1,2,3-triazole-4-carboxamide Openeye Name: 5-amino-1-[[4-(4-chlorobenzoyl)phenyl]methyl]triazole-4-carboxamide CAS Name: 5-amino-1-[[4-[(4-chlorophenyl)-oxomethyl]phenyl]methyl]-4-triazolecarboxamide IUPAC Name: 5-amino-1-[[4-(4-chlorobenzoyl)phenyl]methyl]triazole-4-carboxamide Traditional Name: 5-amino-1-[4-(4-chlorobenzoyl)benzyl]triazole-4-carboxamide Formula: C17H14ClN5O2 MolecularWeight: 355.77836

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C(=C(N=N2)C(=O)N)N)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CC=C1CN2C(=C(N=N2)C(=O)N)N)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H14ClN5O2/c18-13-7-5-12(6-8-13)15(24)11-3-1-10(2-4-11)9-23-16(19)14(17(20)25)21-22-23/h1-8H,9,19H2,(H2,20,25)