methyl 6-azanyl-5-cyano-2-[[3-cyano-6-cyclopropyl-4-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]-4-(4-propan-2-ylphenyl)-4H-pyran-3-carboxylate

Systemtic Name: methyl 6-azanyl-5-cyano-2-[[3-cyano-6-cyclopropyl-4-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]-4-(4-propan-2-ylphenyl)-4H-pyran-3-carboxylate Openeye Name: methyl 6-amino-5-cyano-2-[[3-cyano-6-cyclopropyl-4-(trifluoromethyl)-2-pyridyl]sulfanylmethyl]-4-(4-isopropylphenyl)-4H-pyran-3-carboxylate CAS Name: 6-amino-5-cyano-2-[[[3-cyano-6-cyclopropyl-4-(trifluoromethyl)-2-pyridinyl]thio]methyl]-4-(4-propan-2-ylphenyl)-4H-pyran-3-carboxylic acid methyl ester IUPAC Name: methyl 6-amino-5-cyano-2-[[3-cyano-6-cyclopropyl-4-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]-4-(4-propan-2-ylphenyl)-4H-pyran-3-carboxylate Traditional Name: 6-amino-5-cyano-2-[[[3-cyano-6-cyclopropyl-4-(trifluoromethyl)-2-pyridyl]thio]methyl]-4-p-cumenyl-4H-pyran-3-carboxylic acid methyl ester Formula: C28H25F3N4O3S MolecularWeight: 554.58331

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2C(=C(OC(=C2C(=O)OC)CSC3=C(C(=CC(=N3)C4CC4)C(F)(F)F)C#N)N)C#N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2C(=C(OC(=C2C(=O)OC)CSC3=C(C(=CC(=N3)C4CC4)C(F)(F)F)C#N)N)C#N

InChI

InChI=1S/C28H25F3N4O3S/c1-14(2)15-4-8-17(9-5-15)23-19(12-33)25(34)38-22(24(23)27(36)37-3)13-39-26-18(11-32)20(28(29,30)31)10-21(35-26)16-6-7-16/h4-5,8-10,14,16,23H,6-7,13,34H2,1-3H3