ethyl 3-cyano-5-methyl-6-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]sulfanyl-4-thiophen-2-yl-1,4-dihydropyridine-2-carboxylate

Systemtic Name: ethyl 3-cyano-5-methyl-6-[2-[(2-methylpropan-2-yl)oxy]-2-oxidanylidene-ethyl]sulfanyl-4-thiophen-2-yl-1,4-dihydropyridine-2-carboxylate Openeye Name: ethyl 6-(2-tert-butoxy-2-oxo-ethyl)sulfanyl-3-cyano-5-methyl-4-(2-thienyl)-1,4-dihydropyridine-2-carboxylate CAS Name: 3-cyano-5-methyl-6-[[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]thio]-4-thiophen-2-yl-1,4-dihydropyridine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-5-methyl-6-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]sulfanyl-4-thiophen-2-yl-1,4-dihydropyridine-2-carboxylate Traditional Name: 6-[(2-tert-butoxy-2-keto-ethyl)thio]-3-cyano-5-methyl-4-(2-thienyl)-1,4-dihydropyridine-2-carboxylic acid ethyl ester Formula: C20H24N2O4S2 MolecularWeight: 420.54556

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(C(=C(N1)SCC(=O)OC(C)(C)C)C)C2=CC=CS2)C#N

Isomeric SMILES

CCOC(=O)C1=C(C(C(=C(N1)SCC(=O)OC(C)(C)C)C)C2=CC=CS2)C#N

InChI

InChI=1S/C20H24N2O4S2/c1-6-25-19(24)17-13(10-21)16(14-8-7-9-27-14)12(2)18(22-17)28-11-15(23)26-20(3,4)5/h7-9,16,22H,6,11H2,1-5H3