ethyl 6-[4-[2-[(5-chloranylthiophen-2-yl)sulfonylamino]-2-oxidanylidene-ethyl]piperidin-1-yl]-5-cyano-2-methyl-pyridine-3-carboxylate

Systemtic Name: ethyl 6-[4-[2-[(5-chloranylthiophen-2-yl)sulfonylamino]-2-oxidanylidene-ethyl]piperidin-1-yl]-5-cyano-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 6-[4-[2-[(5-chloro-2-thienyl)sulfonylamino]-2-oxo-ethyl]-1-piperidyl]-5-cyano-2-methyl-pyridine-3-carboxylate CAS Name: 6-[4-[2-[(5-chloro-2-thiophenyl)sulfonylamino]-2-oxoethyl]-1-piperidinyl]-5-cyano-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[4-[2-[(5-chlorothiophen-2-yl)sulfonylamino]-2-oxoethyl]piperidin-1-yl]-5-cyano-2-methylpyridine-3-carboxylate Traditional Name: 6-[4-[2-[(5-chloro-2-thienyl)sulfonylamino]-2-keto-ethyl]piperidino]-5-cyano-2-methyl-nicotinic acid ethyl ester Formula: C21H23ClN4O5S2 MolecularWeight: 511.01412

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)N2CCC(CC2)CC(=O)NS(=O)(=O)C3=CC=C(S3)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)N2CCC(CC2)CC(=O)NS(=O)(=O)C3=CC=C(S3)Cl)C

InChI

InChI=1S/C21H23ClN4O5S2/c1-3-31-21(28)16-11-15(12-23)20(24-13(16)2)26-8-6-14(7-9-26)10-18(27)25-33(29,30)19-5-4-17(22)32-19/h4-5,11,14H,3,6-10H2,1-2H3,(H,25,27)