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

Systemtic Name: 2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]-N-(4-sulfamoylphenyl)ethanamide Openeye Name: 2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]-N-(4-sulfamoylphenyl)acetamide CAS Name: 2-[(6-nitro-1H-benzimidazol-2-yl)thio]-N-(4-sulfamoylphenyl)acetamide IUPAC Name: 2-[(6-nitro-1H-benzimidazol-2-yl)sulfanyl]-N-(4-sulfamoylphenyl)acetamide Traditional Name: 2-[(6-nitro-1H-benzimidazol-2-yl)thio]-N-(4-sulfamoylphenyl)acetamide Formula: C15H13N5O5S2 MolecularWeight: 407.42422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)CSC2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-])S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1NC(=O)CSC2=NC3=C(N2)C=C(C=C3)[N+](=O)[O-])S(=O)(=O)N

InChI

InChI=1S/C15H13N5O5S2/c16-27(24,25)11-4-1-9(2-5-11)17-14(21)8-26-15-18-12-6-3-10(20(22)23)7-13(12)19-15/h1-7H,8H2,(H,17,21)(H,18,19)(H2,16,24,25)