2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-[(5-ethanoyl-2-methoxy-phenyl)methylsulfanyl]-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(5-acetyl-2-methoxy-phenyl)methylsulfanyl]-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(5-acetyl-2-methoxyphenyl)methylthio]-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(5-acetyl-2-methoxyphenyl)methylsulfanyl]-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(5-acetyl-2-methoxy-benzyl)thio]-5-(4-fluorophenyl)-6-methyl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C23H19FN2O3S2 MolecularWeight: 454.536963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=C(NC2=O)SCC3=C(C=CC(=C3)C(=O)C)OC)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C2=C(S1)N=C(NC2=O)SCC3=C(C=CC(=C3)C(=O)C)OC)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H19FN2O3S2/c1-12(27)15-6-9-18(29-3)16(10-15)11-30-23-25-21(28)20-19(13(2)31-22(20)26-23)14-4-7-17(24)8-5-14/h4-10H,11H2,1-3H3,(H,25,26,28)