ethyl 5-cyano-6-[(2R)-1-(2-methoxyethylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-2-methyl-pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-6-[(2R)-1-(2-methoxyethylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-[(1R)-2-(2-methoxyethylamino)-1-methyl-2-oxo-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate CAS Name: 5-cyano-6-[[(2R)-1-(2-methoxyethylamino)-1-oxopropan-2-yl]thio]-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-[(2R)-1-(2-methoxyethylamino)-1-oxopropan-2-yl]sulfanyl-2-methylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[[(1R)-2-keto-2-(2-methoxyethylamino)-1-methyl-ethyl]thio]-2-methyl-nicotinic acid ethyl ester Formula: C16H21N3O4S MolecularWeight: 351.42064

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SC(C)C(=O)NCCOC)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)S[C@H](C)C(=O)NCCOC)C

InChI

InChI=1S/C16H21N3O4S/c1-5-23-16(21)13-8-12(9-17)15(19-10(13)2)24-11(3)14(20)18-6-7-22-4/h8,11H,5-7H2,1-4H3,(H,18,20)/t11-/m1/s1