3-[(3,4-dichlorophenyl)methyl]-2-phenethylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one

Systemtic Name: 3-[(3,4-dichlorophenyl)methyl]-2-phenethylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one Openeye Name: 3-[(3,4-dichlorophenyl)methyl]-2-phenethylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one CAS Name: 3-[(3,4-dichlorophenyl)methyl]-2-(phenethylthio)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one IUPAC Name: 3-[(3,4-dichlorophenyl)methyl]-2-phenethylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one Traditional Name: 3-(3,4-dichlorobenzyl)-2-(phenethylthio)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one Formula: C22H20Cl2N2OS MolecularWeight: 431.378

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)N=C(N(C2=O)CC3=CC(=C(C=C3)Cl)Cl)SCCC4=CC=CC=C4

Isomeric SMILES

C1CC2=C(C1)N=C(N(C2=O)CC3=CC(=C(C=C3)Cl)Cl)SCCC4=CC=CC=C4

InChI

InChI=1S/C22H20Cl2N2OS/c23-18-10-9-16(13-19(18)24)14-26-21(27)17-7-4-8-20(17)25-22(26)28-12-11-15-5-2-1-3-6-15/h1-3,5-6,9-10,13H,4,7-8,11-12,14H2