ethyl 5-cyano-6-[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-oxidanylidene-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-6-[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-oxidanylidene-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-oxo-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate CAS Name: 5-cyano-6-[[2-[(2S,6S)-2,6-dimethyl-4-morpholinyl]-2-oxoethyl]thio]-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-[2-[(2S,6S)-2,6-dimethylmorpholin-4-yl]-2-oxoethyl]sulfanyl-2-methylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[[2-[(2S,6S)-2,6-dimethylmorpholino]-2-keto-ethyl]thio]-2-methyl-nicotinic acid ethyl ester Formula: C18H23N3O4S MolecularWeight: 377.45792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC(=O)N2CC(OC(C2)C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC(=O)N2C[C@@H](O[C@H](C2)C)C)C

InChI

InChI=1S/C18H23N3O4S/c1-5-24-18(23)15-6-14(7-19)17(20-13(15)4)26-10-16(22)21-8-11(2)25-12(3)9-21/h6,11-12H,5,8-10H2,1-4H3/t11-,12-/m0/s1