4-chloranyl-3-[(3-methylbutanoylamino)carbamoyl]-N-(3-methylphenyl)benzenesulfonamide

Systemtic Name: 4-chloranyl-3-[(3-methylbutanoylamino)carbamoyl]-N-(3-methylphenyl)benzenesulfonamide Openeye Name: 4-chloro-3-[(3-methylbutanoylamino)carbamoyl]-N-(m-tolyl)benzenesulfonamide CAS Name: 4-chloro-3-[[(3-methyl-1-oxobutyl)hydrazo]-oxomethyl]-N-(3-methylphenyl)benzenesulfonamide IUPAC Name: 4-chloro-3-[(3-methylbutanoylamino)carbamoyl]-N-(3-methylphenyl)benzenesulfonamide Traditional Name: 4-chloro-3-[(isovalerylamino)carbamoyl]-N-(m-tolyl)benzenesulfonamide Formula: C19H22ClN3O4S MolecularWeight: 423.91368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NNC(=O)CC(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NNC(=O)CC(C)C

InChI

InChI=1S/C19H22ClN3O4S/c1-12(2)9-18(24)21-22-19(25)16-11-15(7-8-17(16)20)28(26,27)23-14-6-4-5-13(3)10-14/h4-8,10-12,23H,9H2,1-3H3,(H,21,24)(H,22,25)