1-[bis(fluoranyl)methyl]-2-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-benzimidazole

Systemtic Name: 1-[bis(fluoranyl)methyl]-2-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-benzimidazole Openeye Name: 1-(difluoromethyl)-2-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-benzimidazole CAS Name: 1-(difluoromethyl)-2-[(3-methyl-5-nitro-4-imidazolyl)thio]benzimidazole IUPAC Name: 1-(difluoromethyl)-2-(3-methyl-5-nitroimidazol-4-yl)sulfanylbenzimidazole Traditional Name: 1-(difluoromethyl)-2-[(3-methyl-5-nitro-imidazol-4-yl)thio]benzimidazole Formula: C12H9F2N5O2S MolecularWeight: 325.293966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1SC2=NC3=CC=CC=C3N2C(F)F)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1SC2=NC3=CC=CC=C3N2C(F)F)[N+](=O)[O-]

InChI

InChI=1S/C12H9F2N5O2S/c1-17-6-15-9(19(20)21)10(17)22-12-16-7-4-2-3-5-8(7)18(12)11(13)14/h2-6,11H,1H3