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

Systemtic Name: 3-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-2-phenethylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one Openeye Name: 3-[2-oxo-2-(1-piperidyl)ethyl]-2-phenethylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one CAS Name: 3-[2-oxo-2-(1-piperidinyl)ethyl]-2-(phenethylthio)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one IUPAC Name: 3-(2-oxo-2-piperidin-1-ylethyl)-2-phenethylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one Traditional Name: 3-(2-keto-2-piperidino-ethyl)-2-(phenethylthio)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)CN2C(=O)C3=C(CCC3)N=C2SCCC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)C(=O)CN2C(=O)C3=C(CCC3)N=C2SCCC4=CC=CC=C4

InChI

InChI=1S/C22H27N3O2S/c26-20(24-13-5-2-6-14-24)16-25-21(27)18-10-7-11-19(18)23-22(25)28-15-12-17-8-3-1-4-9-17/h1,3-4,8-9H,2,5-7,10-16H2