1-[4-(3-methylphenyl)piperazin-1-yl]-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanone

Systemtic Name: 1-[4-(3-methylphenyl)piperazin-1-yl]-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-ethanone Openeye Name: 1-[4-(m-tolyl)piperazin-1-yl]-2-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]ethanone CAS Name: 1-[4-(3-methylphenyl)-1-piperazinyl]-2-[[5-(trifluoromethyl)-2-pyridinyl]thio]ethanone IUPAC Name: 1-[4-(3-methylphenyl)piperazin-1-yl]-2-[5-(trifluoromethyl)pyridin-2-yl]sulfanylethanone Traditional Name: 1-[4-(m-tolyl)piperazino]-2-[[5-(trifluoromethyl)-2-pyridyl]thio]ethanone Formula: C19H20F3N3OS MolecularWeight: 395.44181

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CSC3=NC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)CSC3=NC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C19H20F3N3OS/c1-14-3-2-4-16(11-14)24-7-9-25(10-8-24)18(26)13-27-17-6-5-15(12-23-17)19(20,21)22/h2-6,11-12H,7-10,13H2,1H3