2-(4-chloranyl-6-piperidin-1-yl-pyrimidin-2-yl)sulfanyl-N-[[3-(trifluoromethyl)phenyl]methyl]ethanamide

Systemtic Name: 2-(4-chloranyl-6-piperidin-1-yl-pyrimidin-2-yl)sulfanyl-N-[[3-(trifluoromethyl)phenyl]methyl]ethanamide Openeye Name: 2-[4-chloro-6-(1-piperidyl)pyrimidin-2-yl]sulfanyl-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide CAS Name: 2-[[4-chloro-6-(1-piperidinyl)-2-pyrimidinyl]thio]-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide IUPAC Name: 2-(4-chloro-6-piperidin-1-ylpyrimidin-2-yl)sulfanyl-N-[[3-(trifluoromethyl)phenyl]methyl]acetamide Traditional Name: 2-[(4-chloro-6-piperidino-pyrimidin-2-yl)thio]-N-[3-(trifluoromethyl)benzyl]acetamide Formula: C19H20ClF3N4OS MolecularWeight: 444.90151

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC(=NC(=N2)SCC(=O)NCC3=CC(=CC=C3)C(F)(F)F)Cl

Isomeric SMILES

C1CCN(CC1)C2=CC(=NC(=N2)SCC(=O)NCC3=CC(=CC=C3)C(F)(F)F)Cl

InChI

InChI=1S/C19H20ClF3N4OS/c20-15-10-16(27-7-2-1-3-8-27)26-18(25-15)29-12-17(28)24-11-13-5-4-6-14(9-13)19(21,22)23/h4-6,9-10H,1-3,7-8,11-12H2,(H,24,28)