N-[2-(3,4-dimethoxyphenyl)ethyl]-1-phenyl-5-(phenylmethyl)-1,2,4-triazole-3-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-phenyl-5-(phenylmethyl)-1,2,4-triazole-3-carboxamide Openeye Name: 5-benzyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-phenyl-1,2,4-triazole-3-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-phenyl-5-(phenylmethyl)-1,2,4-triazole-3-carboxamide IUPAC Name: 5-benzyl-N-[2-(3,4-dimethoxyphenyl)ethyl]-1-phenyl-1,2,4-triazole-3-carboxamide Traditional Name: 5-benzyl-N-homoveratryl-1-phenyl-1,2,4-triazole-3-carboxamide Formula: C26H26N4O3 MolecularWeight: 442.50964

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)C2=NN(C(=N2)CC3=CC=CC=C3)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)C2=NN(C(=N2)CC3=CC=CC=C3)C4=CC=CC=C4)OC

InChI

InChI=1S/C26H26N4O3/c1-32-22-14-13-20(17-23(22)33-2)15-16-27-26(31)25-28-24(18-19-9-5-3-6-10-19)30(29-25)21-11-7-4-8-12-21/h3-14,17H,15-16,18H2,1-2H3,(H,27,31)