N-(2,4-dimethylphenyl)-3-[[(2-methyl-5-nitro-phenyl)sulfonylamino]carbamoyl]benzenesulfonamide

Systemtic Name: N-(2,4-dimethylphenyl)-3-[[(2-methyl-5-nitro-phenyl)sulfonylamino]carbamoyl]benzenesulfonamide Openeye Name: N-(2,4-dimethylphenyl)-3-[[(2-methyl-5-nitro-phenyl)sulfonylamino]carbamoyl]benzenesulfonamide CAS Name: N-(2,4-dimethylphenyl)-3-[[(2-methyl-5-nitrophenyl)sulfonylhydrazo]-oxomethyl]benzenesulfonamide IUPAC Name: N-(2,4-dimethylphenyl)-3-[[(2-methyl-5-nitrophenyl)sulfonylamino]carbamoyl]benzenesulfonamide Traditional Name: N-(2,4-dimethylphenyl)-3-[[(2-methyl-5-nitro-phenyl)sulfonylamino]carbamoyl]benzenesulfonamide Formula: C22H22N4O7S2 MolecularWeight: 518.56268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NNS(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])C)C

Isomeric SMILES

CC1=CC(=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)NNS(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])C)C

InChI

InChI=1S/C22H22N4O7S2/c1-14-7-10-20(16(3)11-14)24-34(30,31)19-6-4-5-17(12-19)22(27)23-25-35(32,33)21-13-18(26(28)29)9-8-15(21)2/h4-13,24-25H,1-3H3,(H,23,27)