prop-2-enyl (4S)-3-cyano-2-[2-(diethylamino)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-4-phenyl-3,4-dihydropyridine-5-carboxylate

Systemtic Name: prop-2-enyl (4S)-3-cyano-2-[2-(diethylamino)-2-oxidanylidene-ethyl]sulfanyl-6-methyl-4-phenyl-3,4-dihydropyridine-5-carboxylate Openeye Name: allyl (4S)-3-cyano-2-[2-(diethylamino)-2-oxo-ethyl]sulfanyl-6-methyl-4-phenyl-3,4-dihydropyridine-5-carboxylate CAS Name: (4S)-3-cyano-2-[[2-(diethylamino)-2-oxoethyl]thio]-6-methyl-4-phenyl-3,4-dihydropyridine-5-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (4S)-3-cyano-2-[2-(diethylamino)-2-oxoethyl]sulfanyl-6-methyl-4-phenyl-3,4-dihydropyridine-5-carboxylate Traditional Name: (4S)-3-cyano-2-[[2-(diethylamino)-2-keto-ethyl]thio]-6-methyl-4-phenyl-3,4-dihydropyridine-5-carboxylic acid allyl ester Formula: C23H27N3O3S MolecularWeight: 425.54378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O3S/c1-5-13-29-23(28)20-16(4)25-22(30-15-19(27)26(6-2)7-3)18(14-24)21(20)17-11-9-8-10-12-17/h5,8-12,18,21H,1,6-7,13,15H2,2-4H3/t18?,21-/m1/s1