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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)CSC2=NC(=C(C(C2C#N)C3=CC=CS3)C(=O)OCC=C)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)CSC2=NC(=C([C@@H](C2C#N)C3=CC=CS3)C(=O)OCC=C)C

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/h4-10,12,17,22H,1,11,14H2,2-3H3,(H,27,28)/t17?,22-/m0/s1