3-[1-(2-pyrimidin-2-ylsulfanylethanoyl)piperidin-3-yl]-1-pyrrolidin-1-yl-propan-1-one

Systemtic Name: 3-[1-(2-pyrimidin-2-ylsulfanylethanoyl)piperidin-3-yl]-1-pyrrolidin-1-yl-propan-1-one Openeye Name: 3-[1-(2-pyrimidin-2-ylsulfanylacetyl)-3-piperidyl]-1-pyrrolidin-1-yl-propan-1-one CAS Name: 3-[1-[1-oxo-2-(2-pyrimidinylthio)ethyl]-3-piperidinyl]-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: 3-[1-(2-pyrimidin-2-ylsulfanylacetyl)piperidin-3-yl]-1-pyrrolidin-1-ylpropan-1-one Traditional Name: 3-[1-[2-(2-pyrimidylthio)acetyl]-3-piperidyl]-1-pyrrolidino-propan-1-one Formula: C18H26N4O2S MolecularWeight: 362.48964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CCC2CCCN(C2)C(=O)CSC3=NC=CC=N3

Isomeric SMILES

C1CCN(C1)C(=O)CCC2CCCN(C2)C(=O)CSC3=NC=CC=N3

InChI

InChI=1S/C18H26N4O2S/c23-16(21-10-1-2-11-21)7-6-15-5-3-12-22(13-15)17(24)14-25-18-19-8-4-9-20-18/h4,8-9,15H,1-3,5-7,10-14H2