5-(4-fluorophenyl)-6-methyl-2-(3-phenylpropylsulfanyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-fluorophenyl)-6-methyl-2-(3-phenylpropylsulfanyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-fluorophenyl)-6-methyl-2-(3-phenylpropylsulfanyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-fluorophenyl)-6-methyl-2-(3-phenylpropylthio)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 5-(4-fluorophenyl)-6-methyl-2-(3-phenylpropylsulfanyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-fluorophenyl)-6-methyl-2-(3-phenylpropylthio)-3H-thieno[2,3-d]pyrimidin-4-one Formula: C22H19FN2OS2 MolecularWeight: 410.527463

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=C(NC2=O)SCCCC3=CC=CC=C3)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(C2=C(S1)N=C(NC2=O)SCCCC3=CC=CC=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C22H19FN2OS2/c1-14-18(16-9-11-17(23)12-10-16)19-20(26)24-22(25-21(19)28-14)27-13-5-8-15-6-3-2-4-7-15/h2-4,6-7,9-12H,5,8,13H2,1H3,(H,24,25,26)