N-(2-chloranyl-4-fluoranyl-phenyl)-2-[[(3R)-3,5-dicyano-4,4-dimethyl-2-oxidanylidene-1,3-dihydropyridin-6-yl]sulfanyl]ethanamide

Systemtic Name: N-(2-chloranyl-4-fluoranyl-phenyl)-2-[[(3R)-3,5-dicyano-4,4-dimethyl-2-oxidanylidene-1,3-dihydropyridin-6-yl]sulfanyl]ethanamide Openeye Name: N-(2-chloro-4-fluoro-phenyl)-2-[[(3R)-3,5-dicyano-4,4-dimethyl-2-oxo-1,3-dihydropyridin-6-yl]sulfanyl]acetamide CAS Name: N-(2-chloro-4-fluorophenyl)-2-[[(3R)-3,5-dicyano-4,4-dimethyl-2-oxo-1,3-dihydropyridin-6-yl]thio]acetamide IUPAC Name: N-(2-chloro-4-fluorophenyl)-2-[[(3R)-3,5-dicyano-4,4-dimethyl-2-oxo-1,3-dihydropyridin-6-yl]sulfanyl]acetamide Traditional Name: N-(2-chloro-4-fluoro-phenyl)-2-[[(3R)-3,5-dicyano-2-keto-4,4-dimethyl-1,3-dihydropyridin-6-yl]thio]acetamide Formula: C17H14ClFN4O2S MolecularWeight: 392.835063

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(=O)NC(=C1C#N)SCC(=O)NC2=C(C=C(C=C2)F)Cl)C#N)C

Isomeric SMILES

CC1([C@@H](C(=O)NC(=C1C#N)SCC(=O)NC2=C(C=C(C=C2)F)Cl)C#N)C

InChI

InChI=1S/C17H14ClFN4O2S/c1-17(2)10(6-20)15(25)23-16(11(17)7-21)26-8-14(24)22-13-4-3-9(19)5-12(13)18/h3-5,10H,8H2,1-2H3,(H,22,24)(H,23,25)/t10-/m1/s1