2-[5-fluoranyl-2-methyl-1-[3-(trifluoromethyl)phenyl]sulfonyl-indol-3-yl]sulfanyl-N,N-dimethyl-ethanamine

Systemtic Name: 2-[5-fluoranyl-2-methyl-1-[3-(trifluoromethyl)phenyl]sulfonyl-indol-3-yl]sulfanyl-N,N-dimethyl-ethanamine Openeye Name: 2-[5-fluoro-2-methyl-1-[3-(trifluoromethyl)phenyl]sulfonyl-indol-3-yl]sulfanyl-N,N-dimethyl-ethanamine CAS Name: 2-[[5-fluoro-2-methyl-1-[3-(trifluoromethyl)phenyl]sulfonyl-3-indolyl]thio]-N,N-dimethylethanamine IUPAC Name: 2-[5-fluoro-2-methyl-1-[3-(trifluoromethyl)phenyl]sulfonylindol-3-yl]sulfanyl-N,N-dimethylethanamine Traditional Name: 2-[[5-fluoro-2-methyl-1-[3-(trifluoromethyl)phenyl]sulfonyl-indol-3-yl]thio]ethyl-dimethyl-amine Formula: C20H20F4N2O2S2 MolecularWeight: 460.508613

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N1S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)C=CC(=C2)F)SCCN(C)C

Isomeric SMILES

CC1=C(C2=C(N1S(=O)(=O)C3=CC=CC(=C3)C(F)(F)F)C=CC(=C2)F)SCCN(C)C

InChI

InChI=1S/C20H20F4N2O2S2/c1-13-19(29-10-9-25(2)3)17-12-15(21)7-8-18(17)26(13)30(27,28)16-6-4-5-14(11-16)20(22,23)24/h4-8,11-12H,9-10H2,1-3H3