N-[[2-(3-oxidanylpiperidin-1-yl)pyridin-3-yl]methyl]-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[[2-(3-oxidanylpiperidin-1-yl)pyridin-3-yl]methyl]-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-[[2-(3-hydroxy-1-piperidyl)-3-pyridyl]methyl]-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-[[2-(3-hydroxy-1-piperidinyl)-3-pyridinyl]methyl]-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-[[2-(3-hydroxypiperidin-1-yl)pyridin-3-yl]methyl]-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-[[2-(3-hydroxypiperidino)-3-pyridyl]methyl]-2-(2-pyrimidylthio)acetamide Formula: C17H21N5O2S MolecularWeight: 359.44594

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=C(C=CC=N2)CNC(=O)CSC3=NC=CC=N3)O

Isomeric SMILES

C1CC(CN(C1)C2=C(C=CC=N2)CNC(=O)CSC3=NC=CC=N3)O

InChI

InChI=1S/C17H21N5O2S/c23-14-5-2-9-22(11-14)16-13(4-1-6-18-16)10-21-15(24)12-25-17-19-7-3-8-20-17/h1,3-4,6-8,14,23H,2,5,9-12H2,(H,21,24)