1-[4-diphenylphosphorylsulfanyl-1-(4-fluorophenyl)but-1-enyl]-4-fluoranyl-benzene

Systemtic Name: 1-[4-diphenylphosphorylsulfanyl-1-(4-fluorophenyl)but-1-enyl]-4-fluoranyl-benzene Openeye Name: 1-[4-diphenylphosphorylsulfanyl-1-(4-fluorophenyl)but-1-enyl]-4-fluoro-benzene CAS Name: 1-[4-(diphenylphosphorylthio)-1-(4-fluorophenyl)but-1-enyl]-4-fluorobenzene IUPAC Name: 1-[4-diphenylphosphorylsulfanyl-1-(4-fluorophenyl)but-1-enyl]-4-fluorobenzene Traditional Name: 1-[4-(diphenylphosphorylthio)-1-(4-fluorophenyl)but-1-enyl]-4-fluoro-benzene Formula: C28H23F2OPS MolecularWeight: 476.517187

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)SCCC=C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C(C=C1)P(=O)(C2=CC=CC=C2)SCCC=C(C3=CC=C(C=C3)F)C4=CC=C(C=C4)F

InChI

InChI=1S/C28H23F2OPS/c29-24-17-13-22(14-18-24)28(23-15-19-25(30)20-16-23)12-7-21-33-32(31,26-8-3-1-4-9-26)27-10-5-2-6-11-27/h1-6,8-20H,7,21H2