ethyl 6-azanyl-5-cyano-2-[(3-cyano-6-methyl-pyridin-2-yl)sulfanylmethyl]-4-(2-fluorophenyl)-4H-pyran-3-carboxylate

Systemtic Name: ethyl 6-azanyl-5-cyano-2-[(3-cyano-6-methyl-pyridin-2-yl)sulfanylmethyl]-4-(2-fluorophenyl)-4H-pyran-3-carboxylate Openeye Name: ethyl 6-amino-5-cyano-2-[(3-cyano-6-methyl-2-pyridyl)sulfanylmethyl]-4-(2-fluorophenyl)-4H-pyran-3-carboxylate CAS Name: 6-amino-5-cyano-2-[[(3-cyano-6-methyl-2-pyridinyl)thio]methyl]-4-(2-fluorophenyl)-4H-pyran-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-5-cyano-2-[(3-cyano-6-methylpyridin-2-yl)sulfanylmethyl]-4-(2-fluorophenyl)-4H-pyran-3-carboxylate Traditional Name: 6-amino-5-cyano-2-[[(3-cyano-6-methyl-2-pyridyl)thio]methyl]-4-(2-fluorophenyl)-4H-pyran-3-carboxylic acid ethyl ester Formula: C23H19FN4O3S MolecularWeight: 450.485363

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C(C1C2=CC=CC=C2F)C#N)N)CSC3=C(C=CC(=N3)C)C#N

Isomeric SMILES

CCOC(=O)C1=C(OC(=C(C1C2=CC=CC=C2F)C#N)N)CSC3=C(C=CC(=N3)C)C#N

InChI

InChI=1S/C23H19FN4O3S/c1-3-30-23(29)20-18(12-32-22-14(10-25)9-8-13(2)28-22)31-21(27)16(11-26)19(20)15-6-4-5-7-17(15)24/h4-9,19H,3,12,27H2,1-2H3