1-(3-methylpiperidin-1-yl)-2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(3-methylpiperidin-1-yl)-2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanone Openeye Name: 1-(3-methyl-1-piperidyl)-2-[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanone CAS Name: 1-(3-methyl-1-piperidinyl)-2-[[4-thiophen-2-yl-6-(trifluoromethyl)-2-pyrimidinyl]thio]ethanone IUPAC Name: 1-(3-methylpiperidin-1-yl)-2-[4-thiophen-2-yl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanylethanone Traditional Name: 1-(3-methylpiperidino)-2-[[4-(2-thienyl)-6-(trifluoromethyl)pyrimidin-2-yl]thio]ethanone Formula: C17H18F3N3OS2 MolecularWeight: 401.46953

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CSC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CS3

Isomeric SMILES

CC1CCCN(C1)C(=O)CSC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CS3

InChI

InChI=1S/C17H18F3N3OS2/c1-11-4-2-6-23(9-11)15(24)10-26-16-21-12(13-5-3-7-25-13)8-14(22-16)17(18,19)20/h3,5,7-8,11H,2,4,6,9-10H2,1H3