prop-2-enyl (4R)-5-cyano-2-methyl-6-sulfanyl-4-thiophen-2-yl-3,4-dihydropyridine-3-carboxylate

Systemtic Name: prop-2-enyl (4R)-5-cyano-2-methyl-6-sulfanyl-4-thiophen-2-yl-3,4-dihydropyridine-3-carboxylate Openeye Name: allyl (4R)-5-cyano-2-methyl-6-sulfanyl-4-(2-thienyl)-3,4-dihydropyridine-3-carboxylate CAS Name: (4R)-5-cyano-6-mercapto-2-methyl-4-thiophen-2-yl-3,4-dihydropyridine-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (4R)-5-cyano-2-methyl-6-sulfanyl-4-thiophen-2-yl-3,4-dihydropyridine-3-carboxylate Traditional Name: (4R)-5-cyano-6-mercapto-2-methyl-4-(2-thienyl)-3,4-dihydropyridine-3-carboxylic acid allyl ester Formula: C15H14N2O2S2 MolecularWeight: 318.41386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)OCC=C)C2=CC=CS2)C#N)S

Isomeric SMILES

CC1=NC(=C([C@@H](C1C(=O)OCC=C)C2=CC=CS2)C#N)S

InChI

InChI=1S/C15H14N2O2S2/c1-3-6-19-15(18)12-9(2)17-14(20)10(8-16)13(12)11-5-4-7-21-11/h3-5,7,12-13,20H,1,6H2,2H3/t12?,13-/m1/s1