2-[[4-(4-chlorophenyl)carbonylphenyl]methylsulfanyl]-3-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one

Systemtic Name: 2-[[4-(4-chlorophenyl)carbonylphenyl]methylsulfanyl]-3-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one Openeye Name: 2-[[4-(4-chlorobenzoyl)phenyl]methylsulfanyl]-3-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one CAS Name: 2-[[4-[(4-chlorophenyl)-oxomethyl]phenyl]methylthio]-3-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one IUPAC Name: 2-[[4-(4-chlorobenzoyl)phenyl]methylsulfanyl]-3-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one Traditional Name: 2-[[4-(4-chlorobenzoyl)benzyl]thio]-3-methyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one Formula: C22H19ClN2O2S MolecularWeight: 410.91646

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=C(CCC2)N=C1SCC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CN1C(=O)C2=C(CCC2)N=C1SCC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H19ClN2O2S/c1-25-21(27)18-3-2-4-19(18)24-22(25)28-13-14-5-7-15(8-6-14)20(26)16-9-11-17(23)12-10-16/h5-12H,2-4,13H2,1H3