3-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-1H-1,2,4-triazol-5-amine

Systemtic Name: 3-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-1H-1,2,4-triazol-5-amine Openeye Name: 3-[4-(m-tolylmethyl)piperazin-1-yl]-1H-1,2,4-triazol-5-amine CAS Name: 3-[4-[(3-methylphenyl)methyl]-1-piperazinyl]-1H-1,2,4-triazol-5-amine IUPAC Name: 3-[4-[(3-methylphenyl)methyl]piperazin-1-yl]-1H-1,2,4-triazol-5-amine Traditional Name: [3-[4-(3-methylbenzyl)piperazino]-1H-1,2,4-triazol-5-yl]amine Formula: C14H20N6 MolecularWeight: 272.3488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)C3=NNC(=N3)N

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)C3=NNC(=N3)N

InChI

InChI=1S/C14H20N6/c1-11-3-2-4-12(9-11)10-19-5-7-20(8-6-19)14-16-13(15)17-18-14/h2-4,9H,5-8,10H2,1H3,(H3,15,16,17,18)