1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-[(4-methylphenyl)methylsulfanyl]ethanone

Systemtic Name: 1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-[(4-methylphenyl)methylsulfanyl]ethanone Openeye Name: 1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-(p-tolylmethylsulfanyl)ethanone CAS Name: 1-[4-(3-fluorophenyl)sulfonyl-1-piperazinyl]-2-[(4-methylphenyl)methylthio]ethanone IUPAC Name: 1-[4-(3-fluorophenyl)sulfonylpiperazin-1-yl]-2-[(4-methylphenyl)methylsulfanyl]ethanone Traditional Name: 1-[4-(3-fluorophenyl)sulfonylpiperazino]-2-[(4-methylbenzyl)thio]ethanone Formula: C20H23FN2O3S2 MolecularWeight: 422.536623

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F

Isomeric SMILES

CC1=CC=C(C=C1)CSCC(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)F

InChI

InChI=1S/C20H23FN2O3S2/c1-16-5-7-17(8-6-16)14-27-15-20(24)22-9-11-23(12-10-22)28(25,26)19-4-2-3-18(21)13-19/h2-8,13H,9-12,14-15H2,1H3