N-[1-oxidanylidene-1-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethylamino]propan-2-yl]benzamide

Systemtic Name: N-[1-oxidanylidene-1-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethylamino]propan-2-yl]benzamide Openeye Name: N-[1-methyl-2-oxo-2-[2-[4-(2-pyridyl)piperazin-1-yl]sulfonylethylamino]ethyl]benzamide CAS Name: N-[1-oxo-1-[2-[[4-(2-pyridinyl)-1-piperazinyl]sulfonyl]ethylamino]propan-2-yl]benzamide IUPAC Name: N-[1-oxo-1-[2-(4-pyridin-2-ylpiperazin-1-yl)sulfonylethylamino]propan-2-yl]benzamide Traditional Name: N-[2-keto-1-methyl-2-[2-[4-(2-pyridyl)piperazino]sulfonylethylamino]ethyl]benzamide Formula: C21H27N5O4S MolecularWeight: 445.53518

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCS(=O)(=O)N1CCN(CC1)C2=CC=CC=N2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NCCS(=O)(=O)N1CCN(CC1)C2=CC=CC=N2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H27N5O4S/c1-17(24-21(28)18-7-3-2-4-8-18)20(27)23-11-16-31(29,30)26-14-12-25(13-15-26)19-9-5-6-10-22-19/h2-10,17H,11-16H2,1H3,(H,23,27)(H,24,28)