4-[(4-methylphenyl)methylsulfanyl]-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-one

Systemtic Name: 4-[(4-methylphenyl)methylsulfanyl]-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-one Openeye Name: 4-(p-tolylmethylsulfanyl)-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-one CAS Name: 4-[(4-methylphenyl)methylthio]-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-one IUPAC Name: 4-[(4-methylphenyl)methylsulfanyl]-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-one Traditional Name: 4-[(4-methylbenzyl)thio]-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-one Formula: C15H16N2OS MolecularWeight: 272.36534

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC(=O)NC3=C2CCC3

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC(=O)NC3=C2CCC3

InChI

InChI=1S/C15H16N2OS/c1-10-5-7-11(8-6-10)9-19-14-12-3-2-4-13(12)16-15(18)17-14/h5-8H,2-4,9H2,1H3,(H,16,17,18)