3-chloranyl-N-[3-methyl-1-(4-methylsulfanylphenyl)-1-oxidanyl-pentan-2-yl]benzenesulfonamide

Systemtic Name: 3-chloranyl-N-[3-methyl-1-(4-methylsulfanylphenyl)-1-oxidanyl-pentan-2-yl]benzenesulfonamide Openeye Name: 3-chloro-N-[1-[hydroxy-(4-methylsulfanylphenyl)methyl]-2-methyl-butyl]benzenesulfonamide CAS Name: 3-chloro-N-[1-hydroxy-3-methyl-1-[4-(methylthio)phenyl]pentan-2-yl]benzenesulfonamide IUPAC Name: 3-chloro-N-[1-hydroxy-3-methyl-1-(4-methylsulfanylphenyl)pentan-2-yl]benzenesulfonamide Traditional Name: 3-chloro-N-[1-[hydroxy-[4-(methylthio)phenyl]methyl]-2-methyl-butyl]benzenesulfonamide Formula: C19H24ClNO3S2 MolecularWeight: 413.98176

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(C1=CC=C(C=C1)SC)O)NS(=O)(=O)C2=CC(=CC=C2)Cl

Isomeric SMILES

CCC(C)C(C(C1=CC=C(C=C1)SC)O)NS(=O)(=O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C19H24ClNO3S2/c1-4-13(2)18(19(22)14-8-10-16(25-3)11-9-14)21-26(23,24)17-7-5-6-15(20)12-17/h5-13,18-19,21-22H,4H2,1-3H3