N-(1-oxidanylidenepentan-2-yl)-3-(quinolin-8-ylsulfonylamino)benzamide

Systemtic Name: N-(1-oxidanylidenepentan-2-yl)-3-(quinolin-8-ylsulfonylamino)benzamide Openeye Name: N-(1-formylbutyl)-3-(8-quinolylsulfonylamino)benzamide CAS Name: N-(1-oxopentan-2-yl)-3-(8-quinolinylsulfonylamino)benzamide IUPAC Name: N-(1-oxopentan-2-yl)-3-(quinolin-8-ylsulfonylamino)benzamide Traditional Name: N-(1-formylbutyl)-3-(8-quinolylsulfonylamino)benzamide Formula: C21H21N3O4S MolecularWeight: 411.47414

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C=O)NC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=CC=CC3=C2N=CC=C3

Isomeric SMILES

CCCC(C=O)NC(=O)C1=CC(=CC=C1)NS(=O)(=O)C2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C21H21N3O4S/c1-2-6-18(14-25)23-21(26)16-8-3-10-17(13-16)24-29(27,28)19-11-4-7-15-9-5-12-22-20(15)19/h3-5,7-14,18,24H,2,6H2,1H3,(H,23,26)