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

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-1-phenyl-1,2,4-triazole-3-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-1-phenyl-1,2,4-triazole-3-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-1-phenyl-1,2,4-triazole-3-carboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-5-methyl-1-phenyl-1,2,4-triazole-3-carboxamide Traditional Name: N-homoveratryl-5-methyl-1-phenyl-1,2,4-triazole-3-carboxamide Formula: C20H22N4O3 MolecularWeight: 366.41368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NN1C2=CC=CC=C2)C(=O)NCCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC1=NC(=NN1C2=CC=CC=C2)C(=O)NCCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C20H22N4O3/c1-14-22-19(23-24(14)16-7-5-4-6-8-16)20(25)21-12-11-15-9-10-17(26-2)18(13-15)27-3/h4-10,13H,11-12H2,1-3H3,(H,21,25)