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

Systemtic Name: 3-[4-(4-chlorophenyl)piperazin-1-yl]-1H-1,2,4-triazol-5-amine Openeye Name: 3-[4-(4-chlorophenyl)piperazin-1-yl]-1H-1,2,4-triazol-5-amine CAS Name: 3-[4-(4-chlorophenyl)-1-piperazinyl]-1H-1,2,4-triazol-5-amine IUPAC Name: 3-[4-(4-chlorophenyl)piperazin-1-yl]-1H-1,2,4-triazol-5-amine Traditional Name: [3-[4-(4-chlorophenyl)piperazino]-1H-1,2,4-triazol-5-yl]amine Formula: C12H15ClN6 MolecularWeight: 278.7407

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=C(C=C2)Cl)C3=NNC(=N3)N

Isomeric SMILES

C1CN(CCN1C2=CC=C(C=C2)Cl)C3=NNC(=N3)N

InChI

InChI=1S/C12H15ClN6/c13-9-1-3-10(4-2-9)18-5-7-19(8-6-18)12-15-11(14)16-17-12/h1-4H,5-8H2,(H3,14,15,16,17)