ethyl 5-cyano-2-methyl-6-[3-[2-oxidanylidene-2-(phenethylsulfonylamino)ethyl]pyrrolidin-1-yl]pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-2-methyl-6-[3-[2-oxidanylidene-2-(phenethylsulfonylamino)ethyl]pyrrolidin-1-yl]pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-2-methyl-6-[3-[2-oxo-2-(phenethylsulfonylamino)ethyl]pyrrolidin-1-yl]pyridine-3-carboxylate CAS Name: 5-cyano-2-methyl-6-[3-[2-oxo-2-(phenethylsulfonylamino)ethyl]-1-pyrrolidinyl]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-2-methyl-6-[3-[2-oxo-2-(phenethylsulfonylamino)ethyl]pyrrolidin-1-yl]pyridine-3-carboxylate Traditional Name: 5-cyano-6-[3-[2-keto-2-(phenethylsulfonylamino)ethyl]pyrrolidino]-2-methyl-nicotinic acid ethyl ester Formula: C24H28N4O5S MolecularWeight: 484.56792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)N2CCC(C2)CC(=O)NS(=O)(=O)CCC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)N2CCC(C2)CC(=O)NS(=O)(=O)CCC3=CC=CC=C3)C

InChI

InChI=1S/C24H28N4O5S/c1-3-33-24(30)21-14-20(15-25)23(26-17(21)2)28-11-9-19(16-28)13-22(29)27-34(31,32)12-10-18-7-5-4-6-8-18/h4-8,14,19H,3,9-13,16H2,1-2H3,(H,27,29)