ethyl 5-cyano-2-methyl-6-[2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-2-methyl-6-[2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-2-methyl-6-[2-[(1-morpholinocyclohexyl)methylamino]-2-oxo-ethyl]sulfanyl-pyridine-3-carboxylate CAS Name: 5-cyano-2-methyl-6-[[2-[[1-(4-morpholinyl)cyclohexyl]methylamino]-2-oxoethyl]thio]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-2-methyl-6-[2-[(1-morpholin-4-ylcyclohexyl)methylamino]-2-oxoethyl]sulfanylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[[2-keto-2-[(1-morpholinocyclohexyl)methylamino]ethyl]thio]-2-methyl-nicotinic acid ethyl ester Formula: C23H32N4O4S MolecularWeight: 460.58958

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC(=O)NCC2(CCCCC2)N3CCOCC3)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC(=O)NCC2(CCCCC2)N3CCOCC3)C

InChI

InChI=1S/C23H32N4O4S/c1-3-31-22(29)19-13-18(14-24)21(26-17(19)2)32-15-20(28)25-16-23(7-5-4-6-8-23)27-9-11-30-12-10-27/h13H,3-12,15-16H2,1-2H3,(H,25,28)