N-(2-imidazol-1-yl-1-phenyl-ethyl)-1-[(2-methylphenyl)methyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: N-(2-imidazol-1-yl-1-phenyl-ethyl)-1-[(2-methylphenyl)methyl]-1,2,3-triazole-4-carboxamide Openeye Name: N-(2-imidazol-1-yl-1-phenyl-ethyl)-1-(o-tolylmethyl)triazole-4-carboxamide CAS Name: N-[2-(1-imidazolyl)-1-phenylethyl]-1-[(2-methylphenyl)methyl]-4-triazolecarboxamide IUPAC Name: N-(2-imidazol-1-yl-1-phenylethyl)-1-[(2-methylphenyl)methyl]triazole-4-carboxamide Traditional Name: N-(2-imidazol-1-yl-1-phenyl-ethyl)-1-(2-methylbenzyl)triazole-4-carboxamide Formula: C22H22N6O MolecularWeight: 386.44968

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2C=C(N=N2)C(=O)NC(CN3C=CN=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1CN2C=C(N=N2)C(=O)NC(CN3C=CN=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H22N6O/c1-17-7-5-6-10-19(17)13-28-15-21(25-26-28)22(29)24-20(14-27-12-11-23-16-27)18-8-3-2-4-9-18/h2-12,15-16,20H,13-14H2,1H3,(H,24,29)