(4-benzamidophenyl) 2-[2-[bis(fluoranyl)methylsulfanyl]benzimidazol-1-yl]ethanoate

Systemtic Name: (4-benzamidophenyl) 2-[2-[bis(fluoranyl)methylsulfanyl]benzimidazol-1-yl]ethanoate Openeye Name: (4-benzamidophenyl) 2-[2-(difluoromethylsulfanyl)benzimidazol-1-yl]acetate CAS Name: 2-[2-(difluoromethylthio)-1-benzimidazolyl]acetic acid (4-benzamidophenyl) ester IUPAC Name: (4-benzamidophenyl) 2-[2-(difluoromethylsulfanyl)benzimidazol-1-yl]acetate Traditional Name: 2-[2-(difluoromethylthio)benzimidazol-1-yl]acetic acid (4-benzamidophenyl) ester Formula: C23H17F2N3O3S MolecularWeight: 453.461186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)OC(=O)CN3C4=CC=CC=C4N=C3SC(F)F

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)OC(=O)CN3C4=CC=CC=C4N=C3SC(F)F

InChI

InChI=1S/C23H17F2N3O3S/c24-22(25)32-23-27-18-8-4-5-9-19(18)28(23)14-20(29)31-17-12-10-16(11-13-17)26-21(30)15-6-2-1-3-7-15/h1-13,22H,14H2,(H,26,30)