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N-[2-[(4-methylsulfonylphenyl)methylsulfanyl]ethyl]-3-(trifluoromethyl)benzenesulfonamide

N-[2-[(4-methylsulfonylphenyl)methylsulfanyl]ethyl]-3-(trifluoromethyl)benzenesulfonamide

Systemtic Name:N-[2-[(4-methylsulfonylphenyl)methylsulfanyl]ethyl]-3-(trifluoromethyl)benzenesulfonamide
Openeye Name:N-[2-[(4-methylsulfonylphenyl)methylsulfanyl]ethyl]-3-(trifluoromethyl)benzenesulfonamide
CAS Name:N-[2-[(4-methylsulfonylphenyl)methylthio]ethyl]-3-(trifluoromethyl)benzenesulfonamide
IUPAC Name:N-[2-[(4-methylsulfonylphenyl)methylsulfanyl]ethyl]-3-(trifluoromethyl)benzenesulfonamide
Traditional Name:N-[2-[(4-mesylbenzyl)thio]ethyl]-3-(trifluoromethyl)benzenesulfonamide
Formula: C17H18F3NO4S3
MolecularWeight: 453.51933
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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CSCCNS(=O)(=O)C2=CC=CC(=C2)C(F)(F)F


Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CSCCNS(=O)(=O)C2=CC=CC(=C2)C(F)(F)F


InChI

InChI=1S/C17H18F3NO4S3/c1-27(22,23)15-7-5-13(6-8-15)12-26-10-9-21-28(24,25)16-4-2-3-14(11-16)17(18,19)20/h2-8,11,21H,9-10,12H2,1H3


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