4-(1,2,4-triazol-1-ylmethyl)-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide

Systemtic Name: 4-(1,2,4-triazol-1-ylmethyl)-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide Openeye Name: 4-(1,2,4-triazol-1-ylmethyl)-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide CAS Name: 4-(1,2,4-triazol-1-ylmethyl)-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide IUPAC Name: 4-(1,2,4-triazol-1-ylmethyl)-N-[(3,4,5-trimethoxyphenyl)methyl]benzamide Traditional Name: 4-(1,2,4-triazol-1-ylmethyl)-N-(3,4,5-trimethoxybenzyl)benzamide Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CNC(=O)C2=CC=C(C=C2)CN3C=NC=N3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CNC(=O)C2=CC=C(C=C2)CN3C=NC=N3

InChI

InChI=1S/C20H22N4O4/c1-26-17-8-15(9-18(27-2)19(17)28-3)10-22-20(25)16-6-4-14(5-7-16)11-24-13-21-12-23-24/h4-9,12-13H,10-11H2,1-3H3,(H,22,25)