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

Systemtic Name: N-[6-(diethylsulfamoyl)-1,3-benzothiazol-2-yl]-3-nitro-benzamide Openeye Name: N-[6-(diethylsulfamoyl)-1,3-benzothiazol-2-yl]-3-nitro-benzamide CAS Name: N-[6-(diethylsulfamoyl)-1,3-benzothiazol-2-yl]-3-nitrobenzamide IUPAC Name: N-[6-(diethylsulfamoyl)-1,3-benzothiazol-2-yl]-3-nitrobenzamide Traditional Name: N-[6-(diethylsulfamoyl)-1,3-benzothiazol-2-yl]-3-nitro-benzamide Formula: C18H18N4O5S2 MolecularWeight: 434.48932

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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(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O5S2/c1-3-21(4-2)29(26,27)14-8-9-15-16(11-14)28-18(19-15)20-17(23)12-6-5-7-13(10-12)22(24)25/h5-11H,3-4H2,1-2H3,(H,19,20,23)