ethyl 5-cyano-2-methyl-6-[2-oxidanylidene-2-[2-(4-propan-2-ylphenyl)ethylamino]ethyl]sulfanyl-pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-2-methyl-6-[2-oxidanylidene-2-[2-(4-propan-2-ylphenyl)ethylamino]ethyl]sulfanyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-[2-[2-(4-isopropylphenyl)ethylamino]-2-oxo-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate CAS Name: 5-cyano-2-methyl-6-[[2-oxo-2-[2-(4-propan-2-ylphenyl)ethylamino]ethyl]thio]-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-2-methyl-6-[2-oxo-2-[2-(4-propan-2-ylphenyl)ethylamino]ethyl]sulfanylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[[2-keto-2-(2-p-cumenylethylamino)ethyl]thio]-2-methyl-nicotinic acid ethyl ester Formula: C23H27N3O3S MolecularWeight: 425.54378

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC(=O)NCCC2=CC=C(C=C2)C(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC(=O)NCCC2=CC=C(C=C2)C(C)C)C

InChI

InChI=1S/C23H27N3O3S/c1-5-29-23(28)20-12-19(13-24)22(26-16(20)4)30-14-21(27)25-11-10-17-6-8-18(9-7-17)15(2)3/h6-9,12,15H,5,10-11,14H2,1-4H3,(H,25,27)