N-(4-fluorophenyl)-2-[(6-nitro-1H-benzimidazol-3-ium-2-yl)sulfanyl]ethanamide

Systemtic Name: N-(4-fluorophenyl)-2-[(6-nitro-1H-benzimidazol-3-ium-2-yl)sulfanyl]ethanamide Openeye Name: N-(4-fluorophenyl)-2-[(6-nitro-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide CAS Name: N-(4-fluorophenyl)-2-[(6-nitro-1H-benzimidazol-3-ium-2-yl)thio]acetamide IUPAC Name: N-(4-fluorophenyl)-2-[(6-nitro-1H-benzimidazol-3-ium-2-yl)sulfanyl]acetamide Traditional Name: N-(4-fluorophenyl)-2-[(6-nitro-1H-benzimidazol-3-ium-2-yl)thio]acetamide Formula: C15H12FN4O3S+ MolecularWeight: 347.344183

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CSC2=[NH+]C3=C(N2)C=C(C=C3)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CSC2=[NH+]C3=C(N2)C=C(C=C3)[N+](=O)[O-])F

InChI

InChI=1S/C15H11FN4O3S/c16-9-1-3-10(4-2-9)17-14(21)8-24-15-18-12-6-5-11(20(22)23)7-13(12)19-15/h1-7H,8H2,(H,17,21)(H,18,19)/p+1