4-butyl-N-(1-sulfanylpropan-2-yl)benzenesulfonamide

Systemtic Name: 4-butyl-N-(1-sulfanylpropan-2-yl)benzenesulfonamide Openeye Name: 4-butyl-N-(1-methyl-2-sulfanyl-ethyl)benzenesulfonamide CAS Name: 4-butyl-N-(1-mercaptopropan-2-yl)benzenesulfonamide IUPAC Name: 4-butyl-N-(1-sulfanylpropan-2-yl)benzenesulfonamide Traditional Name: 4-butyl-N-(2-mercapto-1-methyl-ethyl)benzenesulfonamide Formula: C13H21NO2S2 MolecularWeight: 287.44134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)S(=O)(=O)NC(C)CS

Isomeric SMILES

CCCCC1=CC=C(C=C1)S(=O)(=O)NC(C)CS

InChI

InChI=1S/C13H21NO2S2/c1-3-4-5-12-6-8-13(9-7-12)18(15,16)14-11(2)10-17/h6-9,11,14,17H,3-5,10H2,1-2H3