2-[1-(4-bromophenyl)sulfonyl-5-fluoranyl-indol-3-yl]sulfanyl-N,N-dimethyl-ethanamine

Systemtic Name: 2-[1-(4-bromophenyl)sulfonyl-5-fluoranyl-indol-3-yl]sulfanyl-N,N-dimethyl-ethanamine Openeye Name: 2-[1-(4-bromophenyl)sulfonyl-5-fluoro-indol-3-yl]sulfanyl-N,N-dimethyl-ethanamine CAS Name: 2-[[1-(4-bromophenyl)sulfonyl-5-fluoro-3-indolyl]thio]-N,N-dimethylethanamine IUPAC Name: 2-[1-(4-bromophenyl)sulfonyl-5-fluoroindol-3-yl]sulfanyl-N,N-dimethylethanamine Traditional Name: 2-[(1-brosyl-5-fluoro-indol-3-yl)thio]ethyl-dimethyl-amine Formula: C18H18BrFN2O2S2 MolecularWeight: 457.380123

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCSC1=CN(C2=C1C=C(C=C2)F)S(=O)(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

CN(C)CCSC1=CN(C2=C1C=C(C=C2)F)S(=O)(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H18BrFN2O2S2/c1-21(2)9-10-25-18-12-22(17-8-5-14(20)11-16(17)18)26(23,24)15-6-3-13(19)4-7-15/h3-8,11-12H,9-10H2,1-2H3