5-azanyl-3-[[3-methyl-4-(phenylcarbonyl)phenyl]methyl]-4H-1,2,3-triazole-5-carboxamide

Systemtic Name: 5-azanyl-3-[[3-methyl-4-(phenylcarbonyl)phenyl]methyl]-4H-1,2,3-triazole-5-carboxamide Openeye Name: 5-amino-3-[(4-benzoyl-3-methyl-phenyl)methyl]-4H-triazole-5-carboxamide CAS Name: 5-amino-3-[(4-benzoyl-3-methylphenyl)methyl]-4H-triazole-5-carboxamide IUPAC Name: 5-amino-3-[(4-benzoyl-3-methylphenyl)methyl]-4H-triazole-5-carboxamide Traditional Name: 5-amino-3-(4-benzoyl-3-methyl-benzyl)-4H-triazole-5-carboxamide Formula: C18H19N5O2 MolecularWeight: 337.37576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)CN2CC(N=N2)(C(=O)N)N)C(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)CN2CC(N=N2)(C(=O)N)N)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H19N5O2/c1-12-9-13(10-23-11-18(20,17(19)25)21-22-23)7-8-15(12)16(24)14-5-3-2-4-6-14/h2-9H,10-11,20H2,1H3,(H2,19,25)