N-(4-methylphenyl)-5-(phenoxymethyl)-1H-1,2,4-triazol-3-amine

Systemtic Name: N-(4-methylphenyl)-5-(phenoxymethyl)-1H-1,2,4-triazol-3-amine Openeye Name: 5-(phenoxymethyl)-N-(p-tolyl)-1H-1,2,4-triazol-3-amine CAS Name: N-(4-methylphenyl)-5-(phenoxymethyl)-1H-1,2,4-triazol-3-amine IUPAC Name: N-(4-methylphenyl)-5-(phenoxymethyl)-1H-1,2,4-triazol-3-amine Traditional Name: [5-(phenoxymethyl)-1H-1,2,4-triazol-3-yl]-(p-tolyl)amine Formula: C16H16N4O MolecularWeight: 280.32444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NNC(=N2)COC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NNC(=N2)COC3=CC=CC=C3

InChI

InChI=1S/C16H16N4O/c1-12-7-9-13(10-8-12)17-16-18-15(19-20-16)11-21-14-5-3-2-4-6-14/h2-10H,11H2,1H3,(H2,17,18,19,20)