4-[[(3-methyl-5-nitro-imidazol-4-yl)amino]methyl]benzenesulfonamide

Systemtic Name: 4-[[(3-methyl-5-nitro-imidazol-4-yl)amino]methyl]benzenesulfonamide Openeye Name: 4-[[(3-methyl-5-nitro-imidazol-4-yl)amino]methyl]benzenesulfonamide CAS Name: 4-[[(3-methyl-5-nitro-4-imidazolyl)amino]methyl]benzenesulfonamide IUPAC Name: 4-[[(3-methyl-5-nitroimidazol-4-yl)amino]methyl]benzenesulfonamide Traditional Name: 4-[[(3-methyl-5-nitro-imidazol-4-yl)amino]methyl]benzenesulfonamide Formula: C11H13N5O4S MolecularWeight: 311.31702

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC(=C1NCC2=CC=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

CN1C=NC(=C1NCC2=CC=C(C=C2)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C11H13N5O4S/c1-15-7-14-11(16(17)18)10(15)13-6-8-2-4-9(5-3-8)21(12,19)20/h2-5,7,13H,6H2,1H3,(H2,12,19,20)