6-(4-fluorophenyl)-2-(2-pyridin-4-ylethylsulfanylmethyl)-1H-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 6-(4-fluorophenyl)-2-(2-pyridin-4-ylethylsulfanylmethyl)-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 6-(4-fluorophenyl)-2-[2-(4-pyridyl)ethylsulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 6-(4-fluorophenyl)-2-[(2-pyridin-4-ylethylthio)methyl]-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 6-(4-fluorophenyl)-2-(2-pyridin-4-ylethylsulfanylmethyl)-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 6-(4-fluorophenyl)-2-[[2-(4-pyridyl)ethylthio]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Formula: C20H16FN3OS2 MolecularWeight: 397.488943

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC3=C(S2)C(=O)N=C(N3)CSCCC4=CC=NC=C4)F

Isomeric SMILES

C1=CC(=CC=C1C2=CC3=C(S2)C(=O)N=C(N3)CSCCC4=CC=NC=C4)F

InChI

InChI=1S/C20H16FN3OS2/c21-15-3-1-14(2-4-15)17-11-16-19(27-17)20(25)24-18(23-16)12-26-10-7-13-5-8-22-9-6-13/h1-6,8-9,11H,7,10,12H2,(H,23,24,25)