4-(4-piperazin-1-yl-6-pyrimidin-2-yl-pyridin-3-yl)-1H-1,2,4-triazol-5-one

Systemtic Name: 4-(4-piperazin-1-yl-6-pyrimidin-2-yl-pyridin-3-yl)-1H-1,2,4-triazol-5-one Openeye Name: 4-(4-piperazin-1-yl-6-pyrimidin-2-yl-3-pyridyl)-1H-1,2,4-triazol-5-one CAS Name: 4-[4-(1-piperazinyl)-6-(2-pyrimidinyl)-3-pyridinyl]-1H-1,2,4-triazol-5-one IUPAC Name: 4-(4-piperazin-1-yl-6-pyrimidin-2-ylpyridin-3-yl)-1H-1,2,4-triazol-5-one Traditional Name: 4-[4-piperazino-6-(2-pyrimidyl)-3-pyridyl]-1H-1,2,4-triazol-5-one Formula: C15H16N8O MolecularWeight: 324.34054

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC(=NC=C2N3C=NNC3=O)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCN1)C2=CC(=NC=C2N3C=NNC3=O)C4=NC=CC=N4

InChI

InChI=1S/C15H16N8O/c24-15-21-20-10-23(15)13-9-19-11(14-17-2-1-3-18-14)8-12(13)22-6-4-16-5-7-22/h1-3,8-10,16H,4-7H2,(H,21,24)