ethyl 5-[[4-[butyl(methyl)sulfamoyl]phenyl]carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-[[4-[butyl(methyl)sulfamoyl]phenyl]carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[[4-[butyl(methyl)sulfamoyl]benzoyl]amino]-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[[4-[butyl(methyl)sulfamoyl]phenyl]-oxomethyl]amino]-4-cyano-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[4-[butyl(methyl)sulfamoyl]benzoyl]amino]-4-cyano-3-methylthiophene-2-carboxylate Traditional Name: 5-[[4-[butyl(methyl)sulfamoyl]benzoyl]amino]-4-cyano-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C21H25N3O5S2 MolecularWeight: 463.5703

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=C(C(=C(S2)C(=O)OCC)C)C#N

Isomeric SMILES

CCCCN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=C(C(=C(S2)C(=O)OCC)C)C#N

InChI

InChI=1S/C21H25N3O5S2/c1-5-7-12-24(4)31(27,28)16-10-8-15(9-11-16)19(25)23-20-17(13-22)14(3)18(30-20)21(26)29-6-2/h8-11H,5-7,12H2,1-4H3,(H,23,25)