ethyl 3-cyano-6-methyl-2-[2-[[3-(trifluoromethyl)phenyl]carbonylamino]phenyl]sulfanyl-pyridine-4-carboxylate

Systemtic Name: ethyl 3-cyano-6-methyl-2-[2-[[3-(trifluoromethyl)phenyl]carbonylamino]phenyl]sulfanyl-pyridine-4-carboxylate Openeye Name: ethyl 3-cyano-6-methyl-2-[2-[[3-(trifluoromethyl)benzoyl]amino]phenyl]sulfanyl-pyridine-4-carboxylate CAS Name: 3-cyano-6-methyl-2-[[2-[[oxo-[3-(trifluoromethyl)phenyl]methyl]amino]phenyl]thio]-4-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-6-methyl-2-[2-[[3-(trifluoromethyl)benzoyl]amino]phenyl]sulfanylpyridine-4-carboxylate Traditional Name: 3-cyano-6-methyl-2-[[2-[[3-(trifluoromethyl)benzoyl]amino]phenyl]thio]isonicotinic acid ethyl ester Formula: C24H18F3N3O3S MolecularWeight: 485.47823

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=NC(=C1C#N)SC2=CC=CC=C2NC(=O)C3=CC(=CC=C3)C(F)(F)F)C

Isomeric SMILES

CCOC(=O)C1=CC(=NC(=C1C#N)SC2=CC=CC=C2NC(=O)C3=CC(=CC=C3)C(F)(F)F)C

InChI

InChI=1S/C24H18F3N3O3S/c1-3-33-23(32)17-11-14(2)29-22(18(17)13-28)34-20-10-5-4-9-19(20)30-21(31)15-7-6-8-16(12-15)24(25,26)27/h4-12H,3H2,1-2H3,(H,30,31)