1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanone

Systemtic Name: 1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanone Openeye Name: 1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]ethanone CAS Name: 1-[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]-2-[[5-(trifluoromethyl)-2-pyridinyl]thio]ethanone IUPAC Name: 1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylethanone Traditional Name: 1-(4-p-phenetylsulfonylpiperazino)-2-[[5-(trifluoromethyl)-2-pyridyl]thio]ethanone Formula: C20H22F3N3O4S2 MolecularWeight: 489.53159

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CSC3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)CSC3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C20H22F3N3O4S2/c1-2-30-16-4-6-17(7-5-16)32(28,29)26-11-9-25(10-12-26)19(27)14-31-18-8-3-15(13-24-18)20(21,22)23/h3-8,13H,2,9-12,14H2,1H3