ethyl 6-azanyl-4-(4-bromanyl-2-fluoranyl-phenyl)-5-cyano-2-[(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylmethyl]-4H-pyran-3-carboxylate

Systemtic Name: ethyl 6-azanyl-4-(4-bromanyl-2-fluoranyl-phenyl)-5-cyano-2-[(3-cyano-4,6-dimethyl-pyridin-2-yl)sulfanylmethyl]-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-4-(4-bromo-2-fluoro-phenyl)-5-cyano-2-[(3-cyano-4,6-dimethyl-2-pyridyl)sulfanylmethyl]-4H-pyran-3-carboxylate CAS Name: 6-amino-4-(4-bromo-2-fluorophenyl)-5-cyano-2-[[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]methyl]-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-4-(4-bromo-2-fluorophenyl)-5-cyano-2-[(3-cyano-4,6-dimethylpyridin-2-yl)sulfanylmethyl]-4H-pyran-3-carboxylate Traditional Name: 6-amino-4-(4-bromo-2-fluoro-phenyl)-5-cyano-2-[[(3-cyano-4,6-dimethyl-2-pyridyl)thio]methyl]-4H-pyran-3-carboxylic acid ethyl ester Formula: C24H20BrFN4O3S MolecularWeight: 543.408003

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=C(C=C(C=C2)Br)F)C#N)N)CSC3=C(C(=CC(=N3)C)C)C#N

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=C(C=C(C=C2)Br)F)C#N)N)CSC3=C(C(=CC(=N3)C)C)C#N

InChI

InChI=1S/C24H20BrFN4O3S/c1-4-32-24(31)21-19(11-34-23-16(9-27)12(2)7-13(3)30-23)33-22(29)17(10-28)20(21)15-6-5-14(25)8-18(15)26/h5-8,20H,4,11,29H2,1-3H3