N3-(4-piperazin-1-ylphenyl)-1-pyridin-2-yl-1,2,4-triazole-3,5-diamine

Systemtic Name: N3-(4-piperazin-1-ylphenyl)-1-pyridin-2-yl-1,2,4-triazole-3,5-diamine Openeye Name: N3-(4-piperazin-1-ylphenyl)-1-(2-pyridyl)-1,2,4-triazole-3,5-diamine CAS Name: N3-[4-(1-piperazinyl)phenyl]-1-(2-pyridinyl)-1,2,4-triazole-3,5-diamine IUPAC Name: 3-N-(4-piperazin-1-ylphenyl)-1-pyridin-2-yl-1,2,4-triazole-3,5-diamine Traditional Name: [5-amino-1-(2-pyridyl)-1,2,4-triazol-3-yl]-(4-piperazinophenyl)amine Formula: C17H20N8 MolecularWeight: 336.3943

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC=C(C=C2)NC3=NN(C(=N3)N)C4=CC=CC=N4

Isomeric SMILES

C1CN(CCN1)C2=CC=C(C=C2)NC3=NN(C(=N3)N)C4=CC=CC=N4

InChI

InChI=1S/C17H20N8/c18-16-22-17(23-25(16)15-3-1-2-8-20-15)21-13-4-6-14(7-5-13)24-11-9-19-10-12-24/h1-8,19H,9-12H2,(H3,18,21,22,23)