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

Systemtic Name: ethyl 5-cyano-6-[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl]sulfanyl-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-[(1S)-2-(ethylamino)-1-methyl-2-oxo-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate CAS Name: 5-cyano-6-[[(2S)-1-(ethylamino)-1-oxopropan-2-yl]thio]-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-[(2S)-1-(ethylamino)-1-oxopropan-2-yl]sulfanyl-2-methylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[[(1S)-2-(ethylamino)-2-keto-1-methyl-ethyl]thio]-2-methyl-nicotinic acid ethyl ester Formula: C15H19N3O3S MolecularWeight: 321.39466

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)SC1=NC(=C(C=C1C#N)C(=O)OCC)C

Isomeric SMILES

CCNC(=O)[C@H](C)SC1=NC(=C(C=C1C#N)C(=O)OCC)C

InChI

InChI=1S/C15H19N3O3S/c1-5-17-13(19)10(4)22-14-11(8-16)7-12(9(3)18-14)15(20)21-6-2/h7,10H,5-6H2,1-4H3,(H,17,19)/t10-/m0/s1