ethyl 5-[[1-(4-chlorophenyl)sulfonylpyrrolidin-2-yl]carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate

Systemtic Name: ethyl 5-[[1-(4-chlorophenyl)sulfonylpyrrolidin-2-yl]carbonylamino]-4-cyano-3-methyl-thiophene-2-carboxylate Openeye Name: ethyl 5-[[1-(4-chlorophenyl)sulfonylpyrrolidine-2-carbonyl]amino]-4-cyano-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[[1-(4-chlorophenyl)sulfonyl-2-pyrrolidinyl]-oxomethyl]amino]-4-cyano-3-methyl-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[1-(4-chlorophenyl)sulfonylpyrrolidine-2-carbonyl]amino]-4-cyano-3-methylthiophene-2-carboxylate Traditional Name: 5-[[1-(4-chlorophenyl)sulfonylprolyl]amino]-4-cyano-3-methyl-thiophene-2-carboxylic acid ethyl ester Formula: C20H20ClN3O5S2 MolecularWeight: 481.9729

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=C(C=C3)Cl)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2CCCN2S(=O)(=O)C3=CC=C(C=C3)Cl)C#N)C

InChI

InChI=1S/C20H20ClN3O5S2/c1-3-29-20(26)17-12(2)15(11-22)19(30-17)23-18(25)16-5-4-10-24(16)31(27,28)14-8-6-13(21)7-9-14/h6-9,16H,3-5,10H2,1-2H3,(H,23,25)