N-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-ethanamide Openeye Name: N-[2-(4-methoxyphenyl)-2-(1-piperidyl)ethyl]-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-[2-(4-methoxyphenyl)-2-(1-piperidinyl)ethyl]-2-[[4-(trifluoromethyl)-2-pyrimidinyl]thio]acetamide IUPAC Name: N-[2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]-2-[4-(trifluoromethyl)pyrimidin-2-yl]sulfanylacetamide Traditional Name: N-[2-(4-methoxyphenyl)-2-piperidino-ethyl]-2-[[4-(trifluoromethyl)pyrimidin-2-yl]thio]acetamide Formula: C21H25F3N4O2S MolecularWeight: 454.50901

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)CSC2=NC=CC(=N2)C(F)(F)F)N3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)C(CNC(=O)CSC2=NC=CC(=N2)C(F)(F)F)N3CCCCC3

InChI

InChI=1S/C21H25F3N4O2S/c1-30-16-7-5-15(6-8-16)17(28-11-3-2-4-12-28)13-26-19(29)14-31-20-25-10-9-18(27-20)21(22,23)24/h5-10,17H,2-4,11-14H2,1H3,(H,26,29)