ethyl 4-(2-chlorophenyl)-5-cyano-6-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]sulfanyl-2-propyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: ethyl 4-(2-chlorophenyl)-5-cyano-6-[2-oxidanylidene-2-[(2,4,6-trimethylphenyl)amino]ethyl]sulfanyl-2-propyl-1,4-dihydropyridine-3-carboxylate Openeye Name: ethyl 4-(2-chlorophenyl)-5-cyano-6-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanyl-2-propyl-1,4-dihydropyridine-3-carboxylate CAS Name: 4-(2-chlorophenyl)-5-cyano-6-[[2-oxo-2-(2,4,6-trimethylanilino)ethyl]thio]-2-propyl-1,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-chlorophenyl)-5-cyano-6-[2-oxo-2-(2,4,6-trimethylanilino)ethyl]sulfanyl-2-propyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 4-(2-chlorophenyl)-5-cyano-6-[(2-keto-2-mesidino-ethyl)thio]-2-propyl-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C29H32ClN3O3S MolecularWeight: 538.10068

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(C(=C(N1)SCC(=O)NC2=C(C=C(C=C2C)C)C)C#N)C3=CC=CC=C3Cl)C(=O)OCC

Isomeric SMILES

CCCC1=C(C(C(=C(N1)SCC(=O)NC2=C(C=C(C=C2C)C)C)C#N)C3=CC=CC=C3Cl)C(=O)OCC

InChI

InChI=1S/C29H32ClN3O3S/c1-6-10-23-26(29(35)36-7-2)25(20-11-8-9-12-22(20)30)21(15-31)28(32-23)37-16-24(34)33-27-18(4)13-17(3)14-19(27)5/h8-9,11-14,25,32H,6-7,10,16H2,1-5H3,(H,33,34)