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

Systemtic Name: ethyl 3-cyano-5-methyl-6-[(2-methylpropan-2-yl)oxycarbonylsulfanylmethyl]-4-thiophen-2-yl-1,4-dihydropyridine-2-carboxylate Openeye Name: ethyl 6-(tert-butoxycarbonylsulfanylmethyl)-3-cyano-5-methyl-4-(2-thienyl)-1,4-dihydropyridine-2-carboxylate CAS Name: 3-cyano-5-methyl-6-[[[(2-methylpropan-2-yl)oxy-oxomethyl]thio]methyl]-4-thiophen-2-yl-1,4-dihydropyridine-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-5-methyl-6-[(2-methylpropan-2-yl)oxycarbonylsulfanylmethyl]-4-thiophen-2-yl-1,4-dihydropyridine-2-carboxylate Traditional Name: 6-[(tert-butoxycarbonylthio)methyl]-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)CSC(=O)OC(C)(C)C)C)C2=CC=CS2)C#N

Isomeric SMILES

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

InChI

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