3-cyano-N-[3-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpropyl]benzamide

Systemtic Name: 3-cyano-N-[3-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpropyl]benzamide Openeye Name: 3-cyano-N-[3-[4-(2-pyridyl)piperazin-1-yl]sulfonylpropyl]benzamide CAS Name: 3-cyano-N-[3-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]propyl]benzamide IUPAC Name: 3-cyano-N-[3-(4-pyridin-2-ylpiperazin-1-yl)sulfonylpropyl]benzamide Traditional Name: 3-cyano-N-[3-[4-(2-pyridyl)piperazino]sulfonylpropyl]benzamide Formula: C20H23N5O3S MolecularWeight: 413.49332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)S(=O)(=O)CCCNC(=O)C3=CC=CC(=C3)C#N

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)S(=O)(=O)CCCNC(=O)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C20H23N5O3S/c21-16-17-5-3-6-18(15-17)20(26)23-9-4-14-29(27,28)25-12-10-24(11-13-25)19-7-1-2-8-22-19/h1-3,5-8,15H,4,9-14H2,(H,23,26)