methyl 4-[2-[bis(fluoranyl)methoxy]phenyl]-5-cyano-2-methyl-6-methylsulfanyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: methyl 4-[2-[bis(fluoranyl)methoxy]phenyl]-5-cyano-2-methyl-6-methylsulfanyl-1,4-dihydropyridine-3-carboxylate Openeye Name: methyl 5-cyano-4-[2-(difluoromethoxy)phenyl]-2-methyl-6-methylsulfanyl-1,4-dihydropyridine-3-carboxylate CAS Name: 5-cyano-4-[2-(difluoromethoxy)phenyl]-2-methyl-6-(methylthio)-1,4-dihydropyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-cyano-4-[2-(difluoromethoxy)phenyl]-2-methyl-6-methylsulfanyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 5-cyano-4-[2-(difluoromethoxy)phenyl]-2-methyl-6-(methylthio)-1,4-dihydropyridine-3-carboxylic acid methyl ester Formula: C17H16F2N2O3S MolecularWeight: 366.382346

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SC)C#N)C2=CC=CC=C2OC(F)F)C(=O)OC

Isomeric SMILES

CC1=C(C(C(=C(N1)SC)C#N)C2=CC=CC=C2OC(F)F)C(=O)OC

InChI

InChI=1S/C17H16F2N2O3S/c1-9-13(16(22)23-2)14(11(8-20)15(21-9)25-3)10-6-4-5-7-12(10)24-17(18)19/h4-7,14,17,21H,1-3H3