(6E)-5,5-dimethyl-6-[(3-methylphenyl)methylidene]-2-(2-methylpropylsulfanyl)-1H-pyrimidin-4-one

Systemtic Name: (6E)-5,5-dimethyl-6-[(3-methylphenyl)methylidene]-2-(2-methylpropylsulfanyl)-1H-pyrimidin-4-one Openeye Name: (6E)-2-isobutylsulfanyl-5,5-dimethyl-6-(m-tolylmethylene)-1H-pyrimidin-4-one CAS Name: (6E)-5,5-dimethyl-6-[(3-methylphenyl)methylidene]-2-(2-methylpropylthio)-1H-pyrimidin-4-one IUPAC Name: (6E)-5,5-dimethyl-6-[(3-methylphenyl)methylidene]-2-(2-methylpropylsulfanyl)-1H-pyrimidin-4-one Traditional Name: (6E)-2-(isobutylthio)-5,5-dimethyl-6-(3-methylbenzylidene)-1H-pyrimidin-4-one Formula: C18H24N2OS MolecularWeight: 316.46096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C=C2C(C(=O)N=C(N2)SCC(C)C)(C)C

Isomeric SMILES

CC1=CC=CC(=C1)/C=C/2\C(C(=O)N=C(N2)SCC(C)C)(C)C

InChI

InChI=1S/C18H24N2OS/c1-12(2)11-22-17-19-15(18(4,5)16(21)20-17)10-14-8-6-7-13(3)9-14/h6-10,12H,11H2,1-5H3,(H,19,20,21)/b15-10+