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

Systemtic Name: N-[5-(diethylsulfamoyl)-2-propan-2-yloxy-phenyl]-5-nitro-1-benzothiophene-2-carboxamide Openeye Name: N-[5-(diethylsulfamoyl)-2-isopropoxy-phenyl]-5-nitro-benzothiophene-2-carboxamide CAS Name: N-[5-(diethylsulfamoyl)-2-propan-2-yloxyphenyl]-5-nitro-1-benzothiophene-2-carboxamide IUPAC Name: N-[5-(diethylsulfamoyl)-2-propan-2-yloxyphenyl]-5-nitro-1-benzothiophene-2-carboxamide Traditional Name: N-[5-(diethylsulfamoyl)-2-isopropoxy-phenyl]-5-nitro-benzothiophene-2-carboxamide Formula: C22H25N3O6S2 MolecularWeight: 491.5804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O6S2/c1-5-24(6-2)33(29,30)17-8-9-19(31-14(3)4)18(13-17)23-22(26)21-12-15-11-16(25(27)28)7-10-20(15)32-21/h7-14H,5-6H2,1-4H3,(H,23,26)