2-oxidanylidene-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylpropyl]-1H-pyridine-3-carboxamide

Systemtic Name: 2-oxidanylidene-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylpropyl]-1H-pyridine-3-carboxamide Openeye Name: 2-oxo-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylpropyl]-1H-pyridine-3-carboxamide CAS Name: 2-oxo-N-[3-[[4-(2-pyrimidinyl)-1-piperazinyl]sulfonyl]propyl]-1H-pyridine-3-carboxamide IUPAC Name: 2-oxo-N-[3-(4-pyrimidin-2-ylpiperazin-1-yl)sulfonylpropyl]-1H-pyridine-3-carboxamide Traditional Name: 2-keto-N-[3-[4-(2-pyrimidyl)piperazino]sulfonylpropyl]-1H-pyridine-3-carboxamide Formula: C17H22N6O4S MolecularWeight: 406.45938

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)S(=O)(=O)CCCNC(=O)C3=CC=CNC3=O

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)S(=O)(=O)CCCNC(=O)C3=CC=CNC3=O

InChI

InChI=1S/C17H22N6O4S/c24-15-14(4-1-5-18-15)16(25)19-8-3-13-28(26,27)23-11-9-22(10-12-23)17-20-6-2-7-21-17/h1-2,4-7H,3,8-13H2,(H,18,24)(H,19,25)