N-[5-(diethylsulfamoyl)-2-(propylamino)phenyl]-2-methyl-5-nitro-benzenesulfonamide

Systemtic Name: N-[5-(diethylsulfamoyl)-2-(propylamino)phenyl]-2-methyl-5-nitro-benzenesulfonamide Openeye Name: N-[5-(diethylsulfamoyl)-2-(propylamino)phenyl]-2-methyl-5-nitro-benzenesulfonamide CAS Name: N-[5-(diethylsulfamoyl)-2-(propylamino)phenyl]-2-methyl-5-nitrobenzenesulfonamide IUPAC Name: N-[5-(diethylsulfamoyl)-2-(propylamino)phenyl]-2-methyl-5-nitrobenzenesulfonamide Traditional Name: N-[5-(diethylsulfamoyl)-2-(propylamino)phenyl]-2-methyl-5-nitro-benzenesulfonamide Formula: C20H28N4O6S2 MolecularWeight: 484.58952

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=C(C=C(C=C1)S(=O)(=O)N(CC)CC)NS(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])C

Isomeric SMILES

CCCNC1=C(C=C(C=C1)S(=O)(=O)N(CC)CC)NS(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])C

InChI

InChI=1S/C20H28N4O6S2/c1-5-12-21-18-11-10-17(32(29,30)23(6-2)7-3)14-19(18)22-31(27,28)20-13-16(24(25)26)9-8-15(20)4/h8-11,13-14,21-22H,5-7,12H2,1-4H3