[2-oxidanylidene-2-[[5-(4-pyrimidin-2-ylpiperazin-1-yl)pyridin-2-yl]amino]ethyl]azanium

Systemtic Name: [2-oxidanylidene-2-[[5-(4-pyrimidin-2-ylpiperazin-1-yl)pyridin-2-yl]amino]ethyl]azanium Openeye Name: [2-oxo-2-[[5-(4-pyrimidin-2-ylpiperazin-1-yl)-2-pyridyl]amino]ethyl]ammonium CAS Name: [2-oxo-2-[[5-[4-(2-pyrimidinyl)-1-piperazinyl]-2-pyridinyl]amino]ethyl]ammonium IUPAC Name: [2-oxo-2-[[5-(4-pyrimidin-2-ylpiperazin-1-yl)pyridin-2-yl]amino]ethyl]azanium Traditional Name: [2-keto-2-[[5-[4-(2-pyrimidyl)piperazino]-2-pyridyl]amino]ethyl]ammonium Formula: C15H20N7O+ MolecularWeight: 314.3656

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CN=C(C=C2)NC(=O)C[NH3+])C3=NC=CC=N3

Isomeric SMILES

C1CN(CCN1C2=CN=C(C=C2)NC(=O)C[NH3+])C3=NC=CC=N3

InChI

InChI=1S/C15H19N7O/c16-10-14(23)20-13-3-2-12(11-19-13)21-6-8-22(9-7-21)15-17-4-1-5-18-15/h1-5,11H,6-10,16H2,(H,19,20,23)/p+1