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

Systemtic Name: 2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-6-methyl-5-(2-methylbutyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]-6-methyl-5-(2-methylbutyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-[(3-fluoro-4-methoxyphenyl)methylthio]-6-methyl-5-(2-methylbutyl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]-6-methyl-5-(2-methylbutyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-[(3-fluoro-4-methoxy-benzyl)thio]-6-methyl-5-(2-methylbutyl)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C20H23FN2O2S2 MolecularWeight: 406.537223

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CC1=C(SC2=C1C(=O)NC(=N2)SCC3=CC(=C(C=C3)OC)F)C

Isomeric SMILES

CCC(C)CC1=C(SC2=C1C(=O)NC(=N2)SCC3=CC(=C(C=C3)OC)F)C

InChI

InChI=1S/C20H23FN2O2S2/c1-5-11(2)8-14-12(3)27-19-17(14)18(24)22-20(23-19)26-10-13-6-7-16(25-4)15(21)9-13/h6-7,9,11H,5,8,10H2,1-4H3,(H,22,23,24)