ethyl 6-[(2R)-1-[[2,6-bis(fluoranyl)phenyl]amino]-1-oxidanylidene-propan-2-yl]sulfanyl-5-cyano-2-methyl-pyridine-3-carboxylate

Systemtic Name: ethyl 6-[(2R)-1-[[2,6-bis(fluoranyl)phenyl]amino]-1-oxidanylidene-propan-2-yl]sulfanyl-5-cyano-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-[(1R)-2-(2,6-difluoroanilino)-1-methyl-2-oxo-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate CAS Name: 5-cyano-6-[[(2R)-1-(2,6-difluoroanilino)-1-oxopropan-2-yl]thio]-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-[(2R)-1-(2,6-difluoroanilino)-1-oxopropan-2-yl]sulfanyl-2-methylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[[(1R)-2-(2,6-difluoroanilino)-2-keto-1-methyl-ethyl]thio]-2-methyl-nicotinic acid ethyl ester Formula: C19H17F2N3O3S MolecularWeight: 405.418386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SC(C)C(=O)NC2=C(C=CC=C2F)F)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)S[C@H](C)C(=O)NC2=C(C=CC=C2F)F)C

InChI

InChI=1S/C19H17F2N3O3S/c1-4-27-19(26)13-8-12(9-22)18(23-10(13)2)28-11(3)17(25)24-16-14(20)6-5-7-15(16)21/h5-8,11H,4H2,1-3H3,(H,24,25)/t11-/m1/s1