(4-methylsulfanylphenyl)-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone

Systemtic Name: (4-methylsulfanylphenyl)-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone Openeye Name: (4-methylsulfanylphenyl)-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone CAS Name: [4-(methylthio)phenyl]-[4-[4-(trifluoromethyl)phenyl]sulfonyl-1-piperazinyl]methanone IUPAC Name: (4-methylsulfanylphenyl)-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazin-1-yl]methanone Traditional Name: [4-(methylthio)phenyl]-[4-[4-(trifluoromethyl)phenyl]sulfonylpiperazino]methanone Formula: C19H19F3N2O3S2 MolecularWeight: 444.49097

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CSC1=CC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C19H19F3N2O3S2/c1-28-16-6-2-14(3-7-16)18(25)23-10-12-24(13-11-23)29(26,27)17-8-4-15(5-9-17)19(20,21)22/h2-9H,10-13H2,1H3