2-[(5-ethanoyl-2-ethoxy-phenyl)methylsulfanyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(5-ethanoyl-2-ethoxy-phenyl)methylsulfanyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(5-acetyl-2-ethoxy-phenyl)methylsulfanyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(5-acetyl-2-ethoxyphenyl)methylthio]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(5-acetyl-2-ethoxyphenyl)methylsulfanyl]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(5-acetyl-2-ethoxy-benzyl)thio]-5-phenyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C23H20N2O3S2 MolecularWeight: 436.5465

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)CSC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)CSC2=NC3=C(C(=CS3)C4=CC=CC=C4)C(=O)N2

InChI

InChI=1S/C23H20N2O3S2/c1-3-28-19-10-9-16(14(2)26)11-17(19)12-30-23-24-21(27)20-18(13-29-22(20)25-23)15-7-5-4-6-8-15/h4-11,13H,3,12H2,1-2H3,(H,24,25,27)