prop-2-enyl (4S)-5-cyano-6-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]sulfanyl-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: prop-2-enyl (4S)-5-cyano-6-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]sulfanyl-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxylate Openeye Name: allyl (4S)-5-cyano-6-[2-(cyclohexylamino)-2-oxo-ethyl]sulfanyl-4-(2-furyl)-2-methyl-1,4-dihydropyridine-3-carboxylate CAS Name: (4S)-5-cyano-6-[[2-(cyclohexylamino)-2-oxoethyl]thio]-4-(2-furanyl)-2-methyl-1,4-dihydropyridine-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (4S)-5-cyano-6-[2-(cyclohexylamino)-2-oxoethyl]sulfanyl-4-(furan-2-yl)-2-methyl-1,4-dihydropyridine-3-carboxylate Traditional Name: (4S)-5-cyano-6-[[2-(cyclohexylamino)-2-keto-ethyl]thio]-4-(2-furyl)-2-methyl-1,4-dihydropyridine-3-carboxylic acid allyl ester Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=C(N1)SCC(=O)NC2CCCCC2)C#N)C3=CC=CO3)C(=O)OCC=C

Isomeric SMILES

CC1=C([C@@H](C(=C(N1)SCC(=O)NC2CCCCC2)C#N)C3=CC=CO3)C(=O)OCC=C

InChI

InChI=1S/C23H27N3O4S/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/h3,7,10,12,16,21,25H,1,4-6,8-9,11,14H2,2H3,(H,26,27)/t21-/m0/s1