3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[[4-(2-pyrimidinyl)-1-piperazinyl]methyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[[4-(2-pyrimidyl)piperazino]methyl]-1,2,3-benzotriazin-4-one Formula: C16H17N7O MolecularWeight: 323.35248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C(=O)C3=CC=CC=C3N=N2)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCN1CN2C(=O)C3=CC=CC=C3N=N2)C4=NC=CC=N4

InChI

InChI=1S/C16H17N7O/c24-15-13-4-1-2-5-14(13)19-20-23(15)12-21-8-10-22(11-9-21)16-17-6-3-7-18-16/h1-7H,8-12H2