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

Systemtic Name: N-[6-(dibutylsulfamoyl)-1,3-benzothiazol-2-yl]-4-nitro-benzamide Openeye Name: N-[6-(dibutylsulfamoyl)-1,3-benzothiazol-2-yl]-4-nitro-benzamide CAS Name: N-[6-(dibutylsulfamoyl)-1,3-benzothiazol-2-yl]-4-nitrobenzamide IUPAC Name: N-[6-(dibutylsulfamoyl)-1,3-benzothiazol-2-yl]-4-nitrobenzamide Traditional Name: N-[6-(dibutylsulfamoyl)-1,3-benzothiazol-2-yl]-4-nitro-benzamide Formula: C22H26N4O5S2 MolecularWeight: 490.59564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4O5S2/c1-3-5-13-25(14-6-4-2)33(30,31)18-11-12-19-20(15-18)32-22(23-19)24-21(27)16-7-9-17(10-8-16)26(28)29/h7-12,15H,3-6,13-14H2,1-2H3,(H,23,24,27)