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

Systemtic Name: 3-[(3-chlorophenyl)methyl]-2-(phenylmethylsulfanyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one Openeye Name: 2-benzylsulfanyl-3-[(3-chlorophenyl)methyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one CAS Name: 3-[(3-chlorophenyl)methyl]-2-(phenylmethylthio)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one IUPAC Name: 2-benzylsulfanyl-3-[(3-chlorophenyl)methyl]-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one Traditional Name: 2-(benzylthio)-3-(3-chlorobenzyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one Formula: C21H19ClN2OS MolecularWeight: 382.90636

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)N=C(N(C2=O)CC3=CC(=CC=C3)Cl)SCC4=CC=CC=C4

Isomeric SMILES

C1CC2=C(C1)N=C(N(C2=O)CC3=CC(=CC=C3)Cl)SCC4=CC=CC=C4

InChI

InChI=1S/C21H19ClN2OS/c22-17-9-4-8-16(12-17)13-24-20(25)18-10-5-11-19(18)23-21(24)26-14-15-6-2-1-3-7-15/h1-4,6-9,12H,5,10-11,13-14H2