5-(4-fluorophenyl)-2-(2-phenoxyethylsulfanyl)-3-phenyl-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 5-(4-fluorophenyl)-2-(2-phenoxyethylsulfanyl)-3-phenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 5-(4-fluorophenyl)-2-(2-phenoxyethylsulfanyl)-3-phenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 5-(4-fluorophenyl)-2-(2-phenoxyethylthio)-3-phenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 5-(4-fluorophenyl)-2-(2-phenoxyethylsulfanyl)-3-phenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 5-(4-fluorophenyl)-2-(2-phenoxyethylthio)-3-phenyl-thieno[2,3-d]pyrimidin-4-one Formula: C26H19FN2O2S2 MolecularWeight: 474.569663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCCOC4=CC=CC=C4)SC=C3C5=CC=C(C=C5)F

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=C(N=C2SCCOC4=CC=CC=C4)SC=C3C5=CC=C(C=C5)F

InChI

InChI=1S/C26H19FN2O2S2/c27-19-13-11-18(12-14-19)22-17-33-24-23(22)25(30)29(20-7-3-1-4-8-20)26(28-24)32-16-15-31-21-9-5-2-6-10-21/h1-14,17H,15-16H2