N-[6-(diethylsulfamoyl)-1,3-benzothiazol-2-yl]-4,5-dimethoxy-2-nitro-benzamide

Systemtic Name: N-[6-(diethylsulfamoyl)-1,3-benzothiazol-2-yl]-4,5-dimethoxy-2-nitro-benzamide Openeye Name: N-[6-(diethylsulfamoyl)-1,3-benzothiazol-2-yl]-4,5-dimethoxy-2-nitro-benzamide CAS Name: N-[6-(diethylsulfamoyl)-1,3-benzothiazol-2-yl]-4,5-dimethoxy-2-nitrobenzamide IUPAC Name: N-[6-(diethylsulfamoyl)-1,3-benzothiazol-2-yl]-4,5-dimethoxy-2-nitrobenzamide Traditional Name: N-[6-(diethylsulfamoyl)-1,3-benzothiazol-2-yl]-4,5-dimethoxy-2-nitro-benzamide Formula: C20H22N4O7S2 MolecularWeight: 494.54128

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC2=C(C=C1)N=C(S2)NC(=O)C3=CC(=C(C=C3[N+](=O)[O-])OC)OC

InChI

InChI=1S/C20H22N4O7S2/c1-5-23(6-2)33(28,29)12-7-8-14-18(9-12)32-20(21-14)22-19(25)13-10-16(30-3)17(31-4)11-15(13)24(26)27/h7-11H,5-6H2,1-4H3,(H,21,22,25)