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

Systemtic Name: 2-(2-phenoxyethylsulfanyl)-3,5-diphenyl-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-(2-phenoxyethylsulfanyl)-3,5-diphenyl-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-(2-phenoxyethylthio)-3,5-diphenyl-4-thieno[2,3-d]pyrimidinone IUPAC Name: 2-(2-phenoxyethylsulfanyl)-3,5-diphenylthieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(2-phenoxyethylthio)-3,5-diphenyl-thieno[2,3-d]pyrimidin-4-one Formula: C26H20N2O2S2 MolecularWeight: 456.5792

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCCOC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C(=N3)SCCOC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H20N2O2S2/c29-25-23-22(19-10-4-1-5-11-19)18-32-24(23)27-26(28(25)20-12-6-2-7-13-20)31-17-16-30-21-14-8-3-9-15-21/h1-15,18H,16-17H2