ethyl (4R)-5-cyano-6-ethylsulfanyl-4-(furan-3-yl)-2-methyl-3,4-dihydropyridine-3-carboxylate

Systemtic Name: ethyl (4R)-5-cyano-6-ethylsulfanyl-4-(furan-3-yl)-2-methyl-3,4-dihydropyridine-3-carboxylate Openeye Name: ethyl (4R)-5-cyano-6-ethylsulfanyl-4-(3-furyl)-2-methyl-3,4-dihydropyridine-3-carboxylate CAS Name: (4R)-5-cyano-6-(ethylthio)-4-(3-furanyl)-2-methyl-3,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-5-cyano-6-ethylsulfanyl-4-(furan-3-yl)-2-methyl-3,4-dihydropyridine-3-carboxylate Traditional Name: (4R)-5-cyano-6-(ethylthio)-4-(3-furyl)-2-methyl-3,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C16H18N2O3S MolecularWeight: 318.39072

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(C(=C(N=C1C)SCC)C#N)C2=COC=C2

Isomeric SMILES

CCOC(=O)C1[C@@H](C(=C(N=C1C)SCC)C#N)C2=COC=C2

InChI

InChI=1S/C16H18N2O3S/c1-4-21-16(19)13-10(3)18-15(22-5-2)12(8-17)14(13)11-6-7-20-9-11/h6-7,9,13-14H,4-5H2,1-3H3/t13?,14-/m1/s1