1-[2-(furan-2-ylmethylsulfanyl)ethanoyl]piperidin-4-one

Systemtic Name: 1-[2-(furan-2-ylmethylsulfanyl)ethanoyl]piperidin-4-one Openeye Name: 1-[2-(2-furylmethylsulfanyl)acetyl]piperidin-4-one CAS Name: 1-[2-(2-furanylmethylthio)-1-oxoethyl]-4-piperidinone IUPAC Name: 1-[2-(furan-2-ylmethylsulfanyl)acetyl]piperidin-4-one Traditional Name: 1-[2-(2-furfurylthio)acetyl]-4-piperidone Formula: C12H15NO3S MolecularWeight: 253.3174

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1=O)C(=O)CSCC2=CC=CO2

Isomeric SMILES

C1CN(CCC1=O)C(=O)CSCC2=CC=CO2

InChI

InChI=1S/C12H15NO3S/c14-10-3-5-13(6-4-10)12(15)9-17-8-11-2-1-7-16-11/h1-2,7H,3-6,8-9H2