2-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-piperidin-1-yl-propanamide

Systemtic Name: 2-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-piperidin-1-yl-propanamide Openeye Name: 2-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-(1-piperidyl)propanamide CAS Name: 2-[[4-phenyl-6-(trifluoromethyl)-2-pyrimidinyl]thio]-N-(1-piperidinyl)propanamide IUPAC Name: 2-[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl-N-piperidin-1-ylpropanamide Traditional Name: 2-[[4-phenyl-6-(trifluoromethyl)pyrimidin-2-yl]thio]-N-piperidino-propionamide Formula: C19H21F3N4OS MolecularWeight: 410.45645

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NN1CCCCC1)SC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NN1CCCCC1)SC2=NC(=CC(=N2)C(F)(F)F)C3=CC=CC=C3

InChI

InChI=1S/C19H21F3N4OS/c1-13(17(27)25-26-10-6-3-7-11-26)28-18-23-15(14-8-4-2-5-9-14)12-16(24-18)19(20,21)22/h2,4-5,8-9,12-13H,3,6-7,10-11H2,1H3,(H,25,27)