1-methyl-5-(4-phenylpiperazin-1-yl)-1,2,4-triazol-3-amine

Systemtic Name: 1-methyl-5-(4-phenylpiperazin-1-yl)-1,2,4-triazol-3-amine Openeye Name: 1-methyl-5-(4-phenylpiperazin-1-yl)-1,2,4-triazol-3-amine CAS Name: 1-methyl-5-(4-phenyl-1-piperazinyl)-1,2,4-triazol-3-amine IUPAC Name: 1-methyl-5-(4-phenylpiperazin-1-yl)-1,2,4-triazol-3-amine Traditional Name: [1-methyl-5-(4-phenylpiperazino)-1,2,4-triazol-3-yl]amine Formula: C13H18N6 MolecularWeight: 258.32222

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=N1)N)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CN1C(=NC(=N1)N)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C13H18N6/c1-17-13(15-12(14)16-17)19-9-7-18(8-10-19)11-5-3-2-4-6-11/h2-6H,7-10H2,1H3,(H2,14,16)