N-methyl-N-(1-sulfanylpropan-2-yl)-4-[3-(trifluoromethyl)phenyl]benzenesulfonamide

Systemtic Name: N-methyl-N-(1-sulfanylpropan-2-yl)-4-[3-(trifluoromethyl)phenyl]benzenesulfonamide Openeye Name: N-methyl-N-(1-methyl-2-sulfanyl-ethyl)-4-[3-(trifluoromethyl)phenyl]benzenesulfonamide CAS Name: N-(1-mercaptopropan-2-yl)-N-methyl-4-[3-(trifluoromethyl)phenyl]benzenesulfonamide IUPAC Name: N-methyl-N-(1-sulfanylpropan-2-yl)-4-[3-(trifluoromethyl)phenyl]benzenesulfonamide Traditional Name: N-(2-mercapto-1-methyl-ethyl)-N-methyl-4-[3-(trifluoromethyl)phenyl]benzenesulfonamide Formula: C17H18F3NO2S2 MolecularWeight: 389.45553

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Descriptors Computed from Structure

Canonical SMILES:

CC(CS)N(C)S(=O)(=O)C1=CC=C(C=C1)C2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

CC(CS)N(C)S(=O)(=O)C1=CC=C(C=C1)C2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C17H18F3NO2S2/c1-12(11-24)21(2)25(22,23)16-8-6-13(7-9-16)14-4-3-5-15(10-14)17(18,19)20/h3-10,12,24H,11H2,1-2H3