prop-2-enyl (4R)-5-cyano-2-methyl-6-sulfanyl-4-thiophen-3-yl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: prop-2-enyl (4R)-5-cyano-2-methyl-6-sulfanyl-4-thiophen-3-yl-1,4-dihydropyridine-3-carboxylate Openeye Name: allyl (4R)-5-cyano-2-methyl-6-sulfanyl-4-(3-thienyl)-1,4-dihydropyridine-3-carboxylate CAS Name: (4R)-5-cyano-6-mercapto-2-methyl-4-(3-thiophenyl)-1,4-dihydropyridine-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (4R)-5-cyano-2-methyl-6-sulfanyl-4-thiophen-3-yl-1,4-dihydropyridine-3-carboxylate Traditional Name: (4R)-5-cyano-6-mercapto-2-methyl-4-(3-thienyl)-1,4-dihydropyridine-3-carboxylic acid allyl ester Formula: C15H14N2O2S2 MolecularWeight: 318.41386

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)S)C#N)C2=CSC=C2)C(=O)OCC=C

Isomeric SMILES

CC1=C([C@@H](C(=C(N1)S)C#N)C2=CSC=C2)C(=O)OCC=C

InChI

InChI=1S/C15H14N2O2S2/c1-3-5-19-15(18)12-9(2)17-14(20)11(7-16)13(12)10-4-6-21-8-10/h3-4,6,8,13,17,20H,1,5H2,2H3/t13-/m1/s1