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

Systemtic Name: prop-2-enyl (4S)-5-cyano-2-methyl-6-[2-[(2-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylate Openeye Name: allyl (4S)-5-cyano-2-methyl-6-[2-(2-methylanilino)-2-oxo-ethyl]sulfanyl-4-(2-thienyl)-1,4-dihydropyridine-3-carboxylate CAS Name: (4S)-5-cyano-2-methyl-6-[[2-(2-methylanilino)-2-oxoethyl]thio]-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (4S)-5-cyano-2-methyl-6-[2-(2-methylanilino)-2-oxoethyl]sulfanyl-4-thiophen-2-yl-1,4-dihydropyridine-3-carboxylate Traditional Name: (4S)-5-cyano-6-[[2-keto-2-(o-toluidino)ethyl]thio]-2-methyl-4-(2-thienyl)-1,4-dihydropyridine-3-carboxylic acid allyl ester Formula: C24H23N3O3S2 MolecularWeight: 465.58772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CSC2=C(C(C(=C(N2)C)C(=O)OCC=C)C3=CC=CS3)C#N

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CSC2=C([C@H](C(=C(N2)C)C(=O)OCC=C)C3=CC=CS3)C#N

InChI

InChI=1S/C24H23N3O3S2/c1-4-11-30-24(29)21-16(3)26-23(17(13-25)22(21)19-10-7-12-31-19)32-14-20(28)27-18-9-6-5-8-15(18)2/h4-10,12,22,26H,1,11,14H2,2-3H3,(H,27,28)/t22-/m0/s1