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

Systemtic Name: 4-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]sulfanyl-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-one Openeye Name: 4-[2-oxo-2-(p-tolyl)ethyl]sulfanyl-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-one CAS Name: 4-[[2-(4-methylphenyl)-2-oxoethyl]thio]-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-one IUPAC Name: 4-[2-(4-methylphenyl)-2-oxoethyl]sulfanyl-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-one Traditional Name: 4-[[2-keto-2-(p-tolyl)ethyl]thio]-1,5,6,7-tetrahydrocyclopenta[d]pyrimidin-2-one Formula: C16H16N2O2S MolecularWeight: 300.37544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16N2O2S/c1-10-5-7-11(8-6-10)14(19)9-21-15-12-3-2-4-13(12)17-16(20)18-15/h5-8H,2-4,9H2,1H3,(H,17,18,20)