1-(3-methoxyphenyl)-N3-(phenylmethyl)-1,2,4-triazole-3,5-diamine

Systemtic Name: 1-(3-methoxyphenyl)-N3-(phenylmethyl)-1,2,4-triazole-3,5-diamine Openeye Name: N3-benzyl-1-(3-methoxyphenyl)-1,2,4-triazole-3,5-diamine CAS Name: 1-(3-methoxyphenyl)-N3-(phenylmethyl)-1,2,4-triazole-3,5-diamine IUPAC Name: 3-N-benzyl-1-(3-methoxyphenyl)-1,2,4-triazole-3,5-diamine Traditional Name: [5-amino-1-(3-methoxyphenyl)-1,2,4-triazol-3-yl]-benzyl-amine Formula: C16H17N5O MolecularWeight: 295.33908

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2C(=NC(=N2)NCC3=CC=CC=C3)N

Isomeric SMILES

COC1=CC=CC(=C1)N2C(=NC(=N2)NCC3=CC=CC=C3)N

InChI

InChI=1S/C16H17N5O/c1-22-14-9-5-8-13(10-14)21-15(17)19-16(20-21)18-11-12-6-3-2-4-7-12/h2-10H,11H2,1H3,(H3,17,18,19,20)