5-tert-butyl-2-methyl-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]benzenesulfonamide

Systemtic Name: 5-tert-butyl-2-methyl-N-[2-[(4-methylsulfonyl-2-nitro-phenyl)amino]ethyl]benzenesulfonamide Openeye Name: 5-tert-butyl-2-methyl-N-[2-(4-methylsulfonyl-2-nitro-anilino)ethyl]benzenesulfonamide CAS Name: 5-tert-butyl-2-methyl-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]benzenesulfonamide IUPAC Name: 5-tert-butyl-2-methyl-N-[2-(4-methylsulfonyl-2-nitroanilino)ethyl]benzenesulfonamide Traditional Name: 5-tert-butyl-N-[2-(4-mesyl-2-nitro-anilino)ethyl]-2-methyl-benzenesulfonamide Formula: C20H27N3O6S2 MolecularWeight: 469.57488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)NCCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(C)(C)C)S(=O)(=O)NCCNC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C20H27N3O6S2/c1-14-6-7-15(20(2,3)4)12-19(14)31(28,29)22-11-10-21-17-9-8-16(30(5,26)27)13-18(17)23(24)25/h6-9,12-13,21-22H,10-11H2,1-5H3