1-(2-pyrimidin-2-ylsulfanylethanoyl)piperidin-4-one

Systemtic Name: 1-(2-pyrimidin-2-ylsulfanylethanoyl)piperidin-4-one Openeye Name: 1-(2-pyrimidin-2-ylsulfanylacetyl)piperidin-4-one CAS Name: 1-[1-oxo-2-(2-pyrimidinylthio)ethyl]-4-piperidinone IUPAC Name: 1-(2-pyrimidin-2-ylsulfanylacetyl)piperidin-4-one Traditional Name: 1-[2-(2-pyrimidylthio)acetyl]-4-piperidone Formula: C11H13N3O2S MolecularWeight: 251.30482

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=O)C(=O)CSC2=NC=CC=N2

Isomeric SMILES

C1CN(CCC1=O)C(=O)CSC2=NC=CC=N2

InChI

InChI=1S/C11H13N3O2S/c15-9-2-6-14(7-3-9)10(16)8-17-11-12-4-1-5-13-11/h1,4-5H,2-3,6-8H2