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

Systemtic Name: 3-[4-[(4-aminophenyl)methyl]piperazin-1-yl]-1H-1,2,4-triazol-5-amine Openeye Name: 3-[4-[(4-aminophenyl)methyl]piperazin-1-yl]-1H-1,2,4-triazol-5-amine CAS Name: 3-[4-[(4-aminophenyl)methyl]-1-piperazinyl]-1H-1,2,4-triazol-5-amine IUPAC Name: 3-[4-[(4-aminophenyl)methyl]piperazin-1-yl]-1H-1,2,4-triazol-5-amine Traditional Name: [3-[4-(4-aminobenzyl)piperazino]-1H-1,2,4-triazol-5-yl]amine Formula: C13H19N7 MolecularWeight: 273.33686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H19N7/c14-11-3-1-10(2-4-11)9-19-5-7-20(8-6-19)13-16-12(15)17-18-13/h1-4H,5-9,14H2,(H3,15,16,17,18)