3-(1-methylimidazol-2-yl)sulfanyl-4-nitro-benzenesulfonamide

Systemtic Name: 3-(1-methylimidazol-2-yl)sulfanyl-4-nitro-benzenesulfonamide Openeye Name: 3-(1-methylimidazol-2-yl)sulfanyl-4-nitro-benzenesulfonamide CAS Name: 3-[(1-methyl-2-imidazolyl)thio]-4-nitrobenzenesulfonamide IUPAC Name: 3-(1-methylimidazol-2-yl)sulfanyl-4-nitrobenzenesulfonamide Traditional Name: 3-[(1-methylimidazol-2-yl)thio]-4-nitro-benzenesulfonamide Formula: C10H10N4O4S2 MolecularWeight: 314.3408

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SC2=C(C=CC(=C2)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

CN1C=CN=C1SC2=C(C=CC(=C2)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C10H10N4O4S2/c1-13-5-4-12-10(13)19-9-6-7(20(11,17)18)2-3-8(9)14(15)16/h2-6H,1H3,(H2,11,17,18)