2-(5-ethanoyl-2-methoxy-phenyl)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]ethanamide

Systemtic Name: 2-(5-ethanoyl-2-methoxy-phenyl)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]ethanamide Openeye Name: 2-(5-acetyl-2-methoxy-phenyl)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]acetamide CAS Name: 2-(5-acetyl-2-methoxyphenyl)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]acetamide IUPAC Name: 2-(5-acetyl-2-methoxyphenyl)-N-[[4-(1,2,4-triazol-1-ylmethyl)phenyl]methyl]acetamide Traditional Name: 2-(5-acetyl-2-methoxy-phenyl)-N-[4-(1,2,4-triazol-1-ylmethyl)benzyl]acetamide Formula: C21H22N4O3 MolecularWeight: 378.42438

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC)CC(=O)NCC2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC)CC(=O)NCC2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C21H22N4O3/c1-15(26)18-7-8-20(28-2)19(9-18)10-21(27)23-11-16-3-5-17(6-4-16)12-25-14-22-13-24-25/h3-9,13-14H,10-12H2,1-2H3,(H,23,27)