N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-[2-(1-piperidyl)-5-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-[2-(1-piperidinyl)-5-(trifluoromethyl)phenyl]-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-[2-piperidin-1-yl-5-(trifluoromethyl)phenyl]-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-[2-piperidino-5-(trifluoromethyl)phenyl]-2-(2-pyrimidylthio)acetamide Formula: C18H19F3N4OS MolecularWeight: 396.42987

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)CSC3=NC=CC=N3

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)C(F)(F)F)NC(=O)CSC3=NC=CC=N3

InChI

InChI=1S/C18H19F3N4OS/c19-18(20,21)13-5-6-15(25-9-2-1-3-10-25)14(11-13)24-16(26)12-27-17-22-7-4-8-23-17/h4-8,11H,1-3,9-10,12H2,(H,24,26)