4-methyl-N-(1-phenylsulfanyloctan-2-yl)benzenesulfonamide

Systemtic Name: 4-methyl-N-(1-phenylsulfanyloctan-2-yl)benzenesulfonamide Openeye Name: 4-methyl-N-[1-(phenylsulfanylmethyl)heptyl]benzenesulfonamide CAS Name: 4-methyl-N-[1-(phenylthio)octan-2-yl]benzenesulfonamide IUPAC Name: 4-methyl-N-(1-phenylsulfanyloctan-2-yl)benzenesulfonamide Traditional Name: 4-methyl-N-[1-[(phenylthio)methyl]heptyl]benzenesulfonamide Formula: C21H29NO2S2 MolecularWeight: 391.59046

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CSC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCC(CSC1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C21H29NO2S2/c1-3-4-5-7-10-19(17-25-20-11-8-6-9-12-20)22-26(23,24)21-15-13-18(2)14-16-21/h6,8-9,11-16,19,22H,3-5,7,10,17H2,1-2H3