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

Systemtic Name: 2-phenethylsulfanyl-3-(phenylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one Openeye Name: 3-benzyl-2-phenethylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one CAS Name: 2-(phenethylthio)-3-(phenylmethyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one IUPAC Name: 3-benzyl-2-phenethylsulfanyl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one Traditional Name: 3-benzyl-2-(phenethylthio)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-one Formula: C22H22N2OS MolecularWeight: 362.48788

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H22N2OS/c25-21-19-12-7-13-20(19)23-22(24(21)16-18-10-5-2-6-11-18)26-15-14-17-8-3-1-4-9-17/h1-6,8-11H,7,12-16H2