5-(4-fluorophenyl)-2-[(3-methoxyphenyl)methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-fluorophenyl)-2-[(3-methoxyphenyl)methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-fluorophenyl)-2-[(3-methoxyphenyl)methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-fluorophenyl)-2-[(3-methoxyphenyl)methylthio]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-(4-fluorophenyl)-2-[(3-methoxyphenyl)methylsulfanyl]-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-fluorophenyl)-2-(m-anisylthio)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C20H15FN2O2S2 MolecularWeight: 398.473703

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CSC2=NC3=C(C(=CS3)C4=CC=C(C=C4)F)C(=O)N2

Isomeric SMILES

COC1=CC=CC(=C1)CSC2=NC3=C(C(=CS3)C4=CC=C(C=C4)F)C(=O)N2

InChI

InChI=1S/C20H15FN2O2S2/c1-25-15-4-2-3-12(9-15)10-27-20-22-18(24)17-16(11-26-19(17)23-20)13-5-7-14(21)8-6-13/h2-9,11H,10H2,1H3,(H,22,23,24)