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

Systemtic Name: 3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-2-(2-methylpropylsulfanyl)thieno[2,3-d]pyrimidin-4-one Openeye Name: 3-(3,4-dimethylphenyl)-5-ethyl-2-isobutylsulfanyl-6-methyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-2-(2-methylpropylthio)-4-thieno[2,3-d]pyrimidinone IUPAC Name: 3-(3,4-dimethylphenyl)-5-ethyl-6-methyl-2-(2-methylpropylsulfanyl)thieno[2,3-d]pyrimidin-4-one Traditional Name: 3-(3,4-dimethylphenyl)-5-ethyl-2-(isobutylthio)-6-methyl-thieno[2,3-d]pyrimidin-4-one Formula: C21H26N2OS2 MolecularWeight: 386.57394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26N2OS2/c1-7-17-15(6)26-19-18(17)20(24)23(21(22-19)25-11-12(2)3)16-9-8-13(4)14(5)10-16/h8-10,12H,7,11H2,1-6H3