3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-2-(phenylmethylsulfanyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one

Systemtic Name: 3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-2-(phenylmethylsulfanyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one Openeye Name: 2-benzylsulfanyl-3-[2-oxo-2-(1-piperidyl)ethyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one CAS Name: 3-[2-oxo-2-(1-piperidinyl)ethyl]-2-(phenylmethylthio)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one IUPAC Name: 2-benzylsulfanyl-3-(2-oxo-2-piperidin-1-ylethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one Traditional Name: 2-(benzylthio)-3-(2-keto-2-piperidino-ethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CN2C(=O)C3=C(CCC3)N=C2SCC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C(=O)CN2C(=O)C3=C(CCC3)N=C2SCC4=CC=CC=C4

InChI

InChI=1S/C21H25N3O2S/c25-19(23-12-5-2-6-13-23)14-24-20(26)17-10-7-11-18(17)22-21(24)27-15-16-8-3-1-4-9-16/h1,3-4,8-9H,2,5-7,10-15H2