1-cyclopropyl-2-(2-fluorophenyl)-2-[4-(4-methylphenyl)sulfonylsulfanylpiperidin-1-yl]ethanone

Systemtic Name: 1-cyclopropyl-2-(2-fluorophenyl)-2-[4-(4-methylphenyl)sulfonylsulfanylpiperidin-1-yl]ethanone Openeye Name: 1-cyclopropyl-2-(2-fluorophenyl)-2-[4-(p-tolylsulfonylsulfanyl)-1-piperidyl]ethanone CAS Name: 1-cyclopropyl-2-(2-fluorophenyl)-2-[4-[(4-methylphenyl)sulfonylthio]-1-piperidinyl]ethanone IUPAC Name: 1-cyclopropyl-2-(2-fluorophenyl)-2-[4-(4-methylphenyl)sulfonylsulfanylpiperidin-1-yl]ethanone Traditional Name: 1-cyclopropyl-2-(2-fluorophenyl)-2-[4-(tosylthio)piperidino]ethanone Formula: C23H26FNO3S2 MolecularWeight: 447.585843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)SC2CCN(CC2)C(C3=CC=CC=C3F)C(=O)C4CC4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)SC2CCN(CC2)C(C3=CC=CC=C3F)C(=O)C4CC4

InChI

InChI=1S/C23H26FNO3S2/c1-16-6-10-19(11-7-16)30(27,28)29-18-12-14-25(15-13-18)22(23(26)17-8-9-17)20-4-2-3-5-21(20)24/h2-7,10-11,17-18,22H,8-9,12-15H2,1H3