ethyl (4S)-5-cyano-4-(furan-2-yl)-2-methyl-6-sulfanyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: ethyl (4S)-5-cyano-4-(furan-2-yl)-2-methyl-6-sulfanyl-1,4-dihydropyridine-3-carboxylate Openeye Name: ethyl (4S)-5-cyano-4-(2-furyl)-2-methyl-6-sulfanyl-1,4-dihydropyridine-3-carboxylate CAS Name: (4S)-5-cyano-4-(2-furanyl)-6-mercapto-2-methyl-1,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-5-cyano-4-(furan-2-yl)-2-methyl-6-sulfanyl-1,4-dihydropyridine-3-carboxylate Traditional Name: (4S)-5-cyano-4-(2-furyl)-6-mercapto-2-methyl-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C14H14N2O3S MolecularWeight: 290.33756

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC=CO2)C#N)S)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C([C@H]1C2=CC=CO2)C#N)S)C

InChI

InChI=1S/C14H14N2O3S/c1-3-18-14(17)11-8(2)16-13(20)9(7-15)12(11)10-5-4-6-19-10/h4-6,12,16,20H,3H2,1-2H3/t12-/m0/s1