2-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-6-(trifluoromethyl)-1H-pyrimidin-4-one

Systemtic Name: 2-[2-(4-methylpiperidin-1-yl)-2-oxidanylidene-ethyl]sulfanyl-6-(trifluoromethyl)-1H-pyrimidin-4-one Openeye Name: 2-[2-(4-methyl-1-piperidyl)-2-oxo-ethyl]sulfanyl-6-(trifluoromethyl)-1H-pyrimidin-4-one CAS Name: 2-[[2-(4-methyl-1-piperidinyl)-2-oxoethyl]thio]-6-(trifluoromethyl)-1H-pyrimidin-4-one IUPAC Name: 2-[2-(4-methylpiperidin-1-yl)-2-oxoethyl]sulfanyl-6-(trifluoromethyl)-1H-pyrimidin-4-one Traditional Name: 2-[[2-keto-2-(4-methylpiperidino)ethyl]thio]-6-(trifluoromethyl)-1H-pyrimidin-4-one Formula: C13H16F3N3O2S MolecularWeight: 335.34525

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=O)CSC2=NC(=O)C=C(N2)C(F)(F)F

Isomeric SMILES

CC1CCN(CC1)C(=O)CSC2=NC(=O)C=C(N2)C(F)(F)F

InChI

InChI=1S/C13H16F3N3O2S/c1-8-2-4-19(5-3-8)11(21)7-22-12-17-9(13(14,15)16)6-10(20)18-12/h6,8H,2-5,7H2,1H3,(H,17,18,20)