ethyl 2-[[4-(dimethylsulfamoyl)phenyl]carbonylamino]-5-nitro-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[4-(dimethylsulfamoyl)phenyl]carbonylamino]-5-nitro-thiophene-3-carboxylate Openeye Name: ethyl 2-[[4-(dimethylsulfamoyl)benzoyl]amino]-5-nitro-thiophene-3-carboxylate CAS Name: 2-[[[4-(dimethylsulfamoyl)phenyl]-oxomethyl]amino]-5-nitro-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-(dimethylsulfamoyl)benzoyl]amino]-5-nitrothiophene-3-carboxylate Traditional Name: 2-[[4-(dimethylsulfamoyl)benzoyl]amino]-5-nitro-thiophene-3-carboxylic acid ethyl ester Formula: C16H17N3O7S2 MolecularWeight: 427.45208

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)[N+](=O)[O-])NC(=O)C2=CC=C(C=C2)S(=O)(=O)N(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)[N+](=O)[O-])NC(=O)C2=CC=C(C=C2)S(=O)(=O)N(C)C

InChI

InChI=1S/C16H17N3O7S2/c1-4-26-16(21)12-9-13(19(22)23)27-15(12)17-14(20)10-5-7-11(8-6-10)28(24,25)18(2)3/h5-9H,4H2,1-3H3,(H,17,20)