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

Systemtic Name: 3-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-1H-1,2,4-triazol-5-amine Openeye Name: 3-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-1H-1,2,4-triazol-5-amine CAS Name: 3-[4-[(3-chlorophenyl)methyl]-1-piperazinyl]-1H-1,2,4-triazol-5-amine IUPAC Name: 3-[4-[(3-chlorophenyl)methyl]piperazin-1-yl]-1H-1,2,4-triazol-5-amine Traditional Name: [3-[4-(3-chlorobenzyl)piperazino]-1H-1,2,4-triazol-5-yl]amine Formula: C13H17ClN6 MolecularWeight: 292.76728

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC(=CC=C2)Cl)C3=NNC(=N3)N

Isomeric SMILES

C1CN(CCN1CC2=CC(=CC=C2)Cl)C3=NNC(=N3)N

InChI

InChI=1S/C13H17ClN6/c14-11-3-1-2-10(8-11)9-19-4-6-20(7-5-19)13-16-12(15)17-18-13/h1-3,8H,4-7,9H2,(H3,15,16,17,18)