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

Systemtic Name: ethyl 4-cyano-3-methyl-5-[(1-thiophen-2-ylsulfonylpiperidin-2-yl)carbonylamino]thiophene-2-carboxylate Openeye Name: ethyl 4-cyano-3-methyl-5-[[1-(2-thienylsulfonyl)piperidine-2-carbonyl]amino]thiophene-2-carboxylate CAS Name: 4-cyano-3-methyl-5-[[oxo-(1-thiophen-2-ylsulfonyl-2-piperidinyl)methyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-cyano-3-methyl-5-[(1-thiophen-2-ylsulfonylpiperidine-2-carbonyl)amino]thiophene-2-carboxylate Traditional Name: 4-cyano-3-methyl-5-[[1-(2-thienylsulfonyl)pipecoloyl]amino]thiophene-2-carboxylic acid ethyl ester Formula: C19H21N3O5S3 MolecularWeight: 467.58214

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2CCCCN2S(=O)(=O)C3=CC=CS3)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)C2CCCCN2S(=O)(=O)C3=CC=CS3)C#N)C

InChI

InChI=1S/C19H21N3O5S3/c1-3-27-19(24)16-12(2)13(11-20)18(29-16)21-17(23)14-7-4-5-9-22(14)30(25,26)15-8-6-10-28-15/h6,8,10,14H,3-5,7,9H2,1-2H3,(H,21,23)