4-[bis(2-methylpropyl)sulfamoyl]-N-[2-(2-cyanoethylsulfanyl)phenyl]benzamide

Systemtic Name: 4-[bis(2-methylpropyl)sulfamoyl]-N-[2-(2-cyanoethylsulfanyl)phenyl]benzamide Openeye Name: N-[2-(2-cyanoethylsulfanyl)phenyl]-4-(diisobutylsulfamoyl)benzamide CAS Name: 4-[bis(2-methylpropyl)sulfamoyl]-N-[2-(2-cyanoethylthio)phenyl]benzamide IUPAC Name: 4-[bis(2-methylpropyl)sulfamoyl]-N-[2-(2-cyanoethylsulfanyl)phenyl]benzamide Traditional Name: N-[2-(2-cyanoethylthio)phenyl]-4-(diisobutylsulfamoyl)benzamide Formula: C24H31N3O3S2 MolecularWeight: 473.65124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2SCCC#N

Isomeric SMILES

CC(C)CN(CC(C)C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=CC=CC=C2SCCC#N

InChI

InChI=1S/C24H31N3O3S2/c1-18(2)16-27(17-19(3)4)32(29,30)21-12-10-20(11-13-21)24(28)26-22-8-5-6-9-23(22)31-15-7-14-25/h5-6,8-13,18-19H,7,15-17H2,1-4H3,(H,26,28)