N-[5-(diethylsulfamoyl)-2-ethoxy-phenyl]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: N-[5-(diethylsulfamoyl)-2-ethoxy-phenyl]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[5-(diethylsulfamoyl)-2-ethoxy-phenyl]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[5-(diethylsulfamoyl)-2-ethoxyphenyl]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[5-(diethylsulfamoyl)-2-ethoxy-phenyl]-5-nitro-benzothiophene-2-carboxamide Formula: C21H23N3O6S2 MolecularWeight: 477.55382

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OCC)NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)OCC)NC(=O)C2=CC3=C(S2)C=CC(=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H23N3O6S2/c1-4-23(5-2)32(28,29)16-8-9-18(30-6-3)17(13-16)22-21(25)20-12-14-11-15(24(26)27)7-10-19(14)31-20/h7-13H,4-6H2,1-3H3,(H,22,25)