3-[2-[2,2-bis(fluoranyl)ethoxy]-5-tert-butyl-3-phenyl-phenyl]-1-benzothiophene

Systemtic Name: 3-[2-[2,2-bis(fluoranyl)ethoxy]-5-tert-butyl-3-phenyl-phenyl]-1-benzothiophene Openeye Name: 3-[5-tert-butyl-2-(2,2-difluoroethoxy)-3-phenyl-phenyl]benzothiophene CAS Name: 3-[5-tert-butyl-2-(2,2-difluoroethoxy)-3-phenylphenyl]-1-benzothiophene IUPAC Name: 3-[5-tert-butyl-2-(2,2-difluoroethoxy)-3-phenylphenyl]-1-benzothiophene Traditional Name: 3-[5-tert-butyl-2-(2,2-difluoroethoxy)-3-phenyl-phenyl]benzothiophene Formula: C26H24F2OS MolecularWeight: 422.529966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)C2=CC=CC=C2)OCC(F)F)C3=CSC4=CC=CC=C43

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)C2=CC=CC=C2)OCC(F)F)C3=CSC4=CC=CC=C43

InChI

InChI=1S/C26H24F2OS/c1-26(2,3)18-13-20(17-9-5-4-6-10-17)25(29-15-24(27)28)21(14-18)22-16-30-23-12-8-7-11-19(22)23/h4-14,16,24H,15H2,1-3H3