prop-2-enyl (4R)-5-cyano-4-(furan-2-yl)-2-methyl-6-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-3,4-dihydropyridine-3-carboxylate

Systemtic Name: prop-2-enyl (4R)-5-cyano-4-(furan-2-yl)-2-methyl-6-(2-oxidanylidene-2-phenylazanyl-ethyl)sulfanyl-3,4-dihydropyridine-3-carboxylate Openeye Name: allyl (4R)-6-(2-anilino-2-oxo-ethyl)sulfanyl-5-cyano-4-(2-furyl)-2-methyl-3,4-dihydropyridine-3-carboxylate CAS Name: (4R)-6-[(2-anilino-2-oxoethyl)thio]-5-cyano-4-(2-furanyl)-2-methyl-3,4-dihydropyridine-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (4R)-6-(2-anilino-2-oxoethyl)sulfanyl-5-cyano-4-(furan-2-yl)-2-methyl-3,4-dihydropyridine-3-carboxylate Traditional Name: (4R)-6-[(2-anilino-2-keto-ethyl)thio]-5-cyano-4-(2-furyl)-2-methyl-3,4-dihydropyridine-3-carboxylic acid allyl ester Formula: C23H21N3O4S MolecularWeight: 435.49554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)OCC=C)C2=CC=CO2)C#N)SCC(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=NC(=C([C@@H](C1C(=O)OCC=C)C2=CC=CO2)C#N)SCC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C23H21N3O4S/c1-3-11-30-23(28)20-15(2)25-22(17(13-24)21(20)18-10-7-12-29-18)31-14-19(27)26-16-8-5-4-6-9-16/h3-10,12,20-21H,1,11,14H2,2H3,(H,26,27)/t20?,21-/m1/s1