5-chloranyl-6-fluoranyl-2-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-1H-benzimidazole

Systemtic Name: 5-chloranyl-6-fluoranyl-2-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-1H-benzimidazole Openeye Name: 5-chloro-6-fluoro-2-(3-methyl-5-nitro-imidazol-4-yl)sulfanyl-1H-benzimidazole CAS Name: 5-chloro-6-fluoro-2-[(3-methyl-5-nitro-4-imidazolyl)thio]-1H-benzimidazole IUPAC Name: 5-chloro-6-fluoro-2-(3-methyl-5-nitroimidazol-4-yl)sulfanyl-1H-benzimidazole Traditional Name: 5-chloro-6-fluoro-2-[(3-methyl-5-nitro-imidazol-4-yl)thio]-1H-benzimidazole Formula: C11H7ClFN5O2S MolecularWeight: 327.721983

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1SC2=NC3=CC(=C(C=C3N2)F)Cl)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1SC2=NC3=CC(=C(C=C3N2)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C11H7ClFN5O2S/c1-17-4-14-9(18(19)20)10(17)21-11-15-7-2-5(12)6(13)3-8(7)16-11/h2-4H,1H3,(H,15,16)