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

Systemtic Name: 1-(3-ethanoylphenyl)-4-(phenylmethylsulfanyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one Openeye Name: 1-(3-acetylphenyl)-4-benzylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one CAS Name: 1-(3-acetylphenyl)-4-(phenylmethylthio)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one IUPAC Name: 1-(3-acetylphenyl)-4-benzylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one Traditional Name: 1-(3-acetylphenyl)-4-(benzylthio)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-one Formula: C22H20N2O2S MolecularWeight: 376.4714

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)N2C3=C(CCC3)C(=NC2=O)SCC4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)N2C3=C(CCC3)C(=NC2=O)SCC4=CC=CC=C4

InChI

InChI=1S/C22H20N2O2S/c1-15(25)17-9-5-10-18(13-17)24-20-12-6-11-19(20)21(23-22(24)26)27-14-16-7-3-2-4-8-16/h2-5,7-10,13H,6,11-12,14H2,1H3