1-[4-(4-methylpiperazin-1-yl)phenyl]-1,2,4-triazole-3,5-diamine

Systemtic Name: 1-[4-(4-methylpiperazin-1-yl)phenyl]-1,2,4-triazole-3,5-diamine Openeye Name: 1-[4-(4-methylpiperazin-1-yl)phenyl]-1,2,4-triazole-3,5-diamine CAS Name: 1-[4-(4-methyl-1-piperazinyl)phenyl]-1,2,4-triazole-3,5-diamine IUPAC Name: 1-[4-(4-methylpiperazin-1-yl)phenyl]-1,2,4-triazole-3,5-diamine Traditional Name: [5-amino-1-[4-(4-methylpiperazino)phenyl]-1,2,4-triazol-3-yl]amine Formula: C13H19N7 MolecularWeight: 273.33686

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=C(C=C2)N3C(=NC(=N3)N)N

Isomeric SMILES

CN1CCN(CC1)C2=CC=C(C=C2)N3C(=NC(=N3)N)N

InChI

InChI=1S/C13H19N7/c1-18-6-8-19(9-7-18)10-2-4-11(5-3-10)20-13(15)16-12(14)17-20/h2-5H,6-9H2,1H3,(H4,14,15,16,17)