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

Systemtic Name: ethyl (4R)-3-cyano-2-[2-(diethylamino)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-4-thiophen-2-yl-3,4-dihydropyridine-5-carboxylate Openeye Name: ethyl (4R)-3-cyano-2-[2-(diethylamino)-2-oxo-ethyl]sulfanyl-6-methyl-4-(2-thienyl)-3,4-dihydropyridine-5-carboxylate CAS Name: (4R)-3-cyano-2-[[2-(diethylamino)-2-oxoethyl]thio]-6-methyl-4-thiophen-2-yl-3,4-dihydropyridine-5-carboxylic acid ethyl ester IUPAC Name: ethyl (4R)-3-cyano-2-[2-(diethylamino)-2-oxoethyl]sulfanyl-6-methyl-4-thiophen-2-yl-3,4-dihydropyridine-5-carboxylate Traditional Name: (4R)-3-cyano-2-[[2-(diethylamino)-2-keto-ethyl]thio]-6-methyl-4-(2-thienyl)-3,4-dihydropyridine-5-carboxylic acid ethyl ester Formula: C20H25N3O3S2 MolecularWeight: 419.5608

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CSC1=NC(=C(C(C1C#N)C2=CC=CS2)C(=O)OCC)C

Isomeric SMILES

CCN(CC)C(=O)CSC1=NC(=C([C@@H](C1C#N)C2=CC=CS2)C(=O)OCC)C

InChI

InChI=1S/C20H25N3O3S2/c1-5-23(6-2)16(24)12-28-19-14(11-21)18(15-9-8-10-27-15)17(13(4)22-19)20(25)26-7-3/h8-10,14,18H,5-7,12H2,1-4H3/t14?,18-/m0/s1