1-[4-bromanyl-2-(trifluoromethyloxy)phenyl]sulfonyl-4-(2-methylsulfanylphenyl)piperazine

Systemtic Name: 1-[4-bromanyl-2-(trifluoromethyloxy)phenyl]sulfonyl-4-(2-methylsulfanylphenyl)piperazine Openeye Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-4-(2-methylsulfanylphenyl)piperazine CAS Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-4-[2-(methylthio)phenyl]piperazine IUPAC Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-4-(2-methylsulfanylphenyl)piperazine Traditional Name: 1-[4-bromo-2-(trifluoromethoxy)phenyl]sulfonyl-4-[2-(methylthio)phenyl]piperazine Formula: C18H18BrF3N2O3S2 MolecularWeight: 511.37633

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3)Br)OC(F)(F)F

Isomeric SMILES

CSC1=CC=CC=C1N2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3)Br)OC(F)(F)F

InChI

InChI=1S/C18H18BrF3N2O3S2/c1-28-16-5-3-2-4-14(16)23-8-10-24(11-9-23)29(25,26)17-7-6-13(19)12-15(17)27-18(20,21)22/h2-7,12H,8-11H2,1H3