4-methyl-N-[octylsulfanyl(phenyl)methyl]benzenesulfonamide

Systemtic Name: 4-methyl-N-[octylsulfanyl(phenyl)methyl]benzenesulfonamide Openeye Name: 4-methyl-N-[octylsulfanyl(phenyl)methyl]benzenesulfonamide CAS Name: 4-methyl-N-[(octylthio)-phenylmethyl]benzenesulfonamide IUPAC Name: 4-methyl-N-[octylsulfanyl(phenyl)methyl]benzenesulfonamide Traditional Name: 4-methyl-N-[(octylthio)-phenyl-methyl]benzenesulfonamide Formula: C22H31NO2S2 MolecularWeight: 405.61704

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSC(C1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCCCSC(C1=CC=CC=C1)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C22H31NO2S2/c1-3-4-5-6-7-11-18-26-22(20-12-9-8-10-13-20)23-27(24,25)21-16-14-19(2)15-17-21/h8-10,12-17,22-23H,3-7,11,18H2,1-2H3