3-butyl-2-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=C(N=C1SCC3=CC(=C(C=C3)OC)F)SC(=C2C)C

Isomeric SMILES

CCCCN1C(=O)C2=C(N=C1SCC3=CC(=C(C=C3)OC)F)SC(=C2C)C

InChI

InChI=1S/C20H23FN2O2S2/c1-5-6-9-23-19(24)17-12(2)13(3)27-18(17)22-20(23)26-11-14-7-8-16(25-4)15(21)10-14/h7-8,10H,5-6,9,11H2,1-4H3