2-pyridin-4-ylsulfanyl-N-[(3R)-1-pyrimidin-2-ylpiperidin-3-yl]ethanamide

Systemtic Name: 2-pyridin-4-ylsulfanyl-N-[(3R)-1-pyrimidin-2-ylpiperidin-3-yl]ethanamide Openeye Name: 2-(4-pyridylsulfanyl)-N-[(3R)-1-pyrimidin-2-yl-3-piperidyl]acetamide CAS Name: 2-(pyridin-4-ylthio)-N-[(3R)-1-(2-pyrimidinyl)-3-piperidinyl]acetamide IUPAC Name: 2-pyridin-4-ylsulfanyl-N-[(3R)-1-pyrimidin-2-ylpiperidin-3-yl]acetamide Traditional Name: 2-(4-pyridylthio)-N-[(3R)-1-(2-pyrimidyl)-3-piperidyl]acetamide Formula: C16H19N5OS MolecularWeight: 329.41996

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=NC=CC=N2)NC(=O)CSC3=CC=NC=C3

Isomeric SMILES

C1C[C@H](CN(C1)C2=NC=CC=N2)NC(=O)CSC3=CC=NC=C3

InChI

InChI=1S/C16H19N5OS/c22-15(12-23-14-4-8-17-9-5-14)20-13-3-1-10-21(11-13)16-18-6-2-7-19-16/h2,4-9,13H,1,3,10-12H2,(H,20,22)/t13-/m1/s1