3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-2-(3-oxidanylidenebutan-2-ylsulfanyl)thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-2-(3-oxidanylidenebutan-2-ylsulfanyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-2-(1-methyl-2-oxo-propyl)sulfanyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-2-(3-oxobutan-2-ylthio)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-2-(3-oxobutan-2-ylsulfanyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(3,4-dimethylphenyl)-5-ethyl-2-[(2-keto-1-methyl-propyl)thio]-6-methyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H24N2O2S2 MolecularWeight: 400.55746

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC2=C1C(=O)N(C(=N2)SC(C)C(=O)C)C3=CC(=C(C=C3)C)C)C

Isomeric SMILES

CCC1=C(SC2=C1C(=O)N(C(=N2)SC(C)C(=O)C)C3=CC(=C(C=C3)C)C)C

InChI

InChI=1S/C21H24N2O2S2/c1-7-17-15(6)26-19-18(17)20(25)23(16-9-8-11(2)12(3)10-16)21(22-19)27-14(5)13(4)24/h8-10,14H,7H2,1-6H3