ethyl 5-azanyl-4-cyano-3-[[4-(furan-2-ylmethylsulfamoyl)phenyl]carbonyloxymethyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[[4-(furan-2-ylmethylsulfamoyl)phenyl]carbonyloxymethyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[4-(2-furylmethylsulfamoyl)benzoyl]oxymethyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[[4-(2-furanylmethylsulfamoyl)phenyl]-oxomethoxy]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[[4-(furan-2-ylmethylsulfamoyl)benzoyl]oxymethyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[4-(2-furfurylsulfamoyl)benzoyl]oxymethyl]thiophene-2-carboxylic acid ethyl ester Formula: C21H19N3O7S2 MolecularWeight: 489.52146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CO3

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)N)C#N)COC(=O)C2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CO3

InChI

InChI=1S/C21H19N3O7S2/c1-2-29-21(26)18-17(16(10-22)19(23)32-18)12-31-20(25)13-5-7-15(8-6-13)33(27,28)24-11-14-4-3-9-30-14/h3-9,24H,2,11-12,23H2,1H3