N-(5-tert-butyl-2-oxidanyl-phenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide

Systemtic Name: N-(5-tert-butyl-2-oxidanyl-phenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide Openeye Name: N-(5-tert-butyl-2-hydroxy-phenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide CAS Name: N-(5-tert-butyl-2-hydroxyphenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide IUPAC Name: N-(5-tert-butyl-2-hydroxyphenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide Traditional Name: N-(5-tert-butyl-2-hydroxy-phenyl)-4-(1,2,4-triazol-1-ylmethyl)benzamide Formula: C20H22N4O2 MolecularWeight: 350.41428

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4O2/c1-20(2,3)16-8-9-18(25)17(10-16)23-19(26)15-6-4-14(5-7-15)11-24-13-21-12-22-24/h4-10,12-13,25H,11H2,1-3H3,(H,23,26)