1-[bis(fluoranyl)methyl]-2-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-benzimidazole

Systemtic Name: 1-[bis(fluoranyl)methyl]-2-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-benzimidazole Openeye Name: 1-(difluoromethyl)-2-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-benzimidazole CAS Name: 1-(difluoromethyl)-2-[(4-methylsulfonyl-2-nitrophenyl)thio]benzimidazole IUPAC Name: 1-(difluoromethyl)-2-(4-methylsulfonyl-2-nitrophenyl)sulfanylbenzimidazole Traditional Name: 1-(difluoromethyl)-2-[(4-mesyl-2-nitro-phenyl)thio]benzimidazole Formula: C15H11F2N3O4S2 MolecularWeight: 399.392346

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)SC2=NC3=CC=CC=C3N2C(F)F)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)SC2=NC3=CC=CC=C3N2C(F)F)[N+](=O)[O-]

InChI

InChI=1S/C15H11F2N3O4S2/c1-26(23,24)9-6-7-13(12(8-9)20(21)22)25-15-18-10-4-2-3-5-11(10)19(15)14(16)17/h2-8,14H,1H3