ethyl 6-[2-(tert-butylamino)-2-oxidanylidene-ethyl]sulfanyl-5-cyano-4-(furan-2-yl)-2-phenyl-1,4-dihydropyridine-3-carboxylate

Systemtic Name: ethyl 6-[2-(tert-butylamino)-2-oxidanylidene-ethyl]sulfanyl-5-cyano-4-(furan-2-yl)-2-phenyl-1,4-dihydropyridine-3-carboxylate Openeye Name: ethyl 6-[2-(tert-butylamino)-2-oxo-ethyl]sulfanyl-5-cyano-4-(2-furyl)-2-phenyl-1,4-dihydropyridine-3-carboxylate CAS Name: 6-[[2-(tert-butylamino)-2-oxoethyl]thio]-5-cyano-4-(2-furanyl)-2-phenyl-1,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[2-(tert-butylamino)-2-oxoethyl]sulfanyl-5-cyano-4-(furan-2-yl)-2-phenyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 6-[[2-(tert-butylamino)-2-keto-ethyl]thio]-5-cyano-4-(2-furyl)-2-phenyl-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C25H27N3O4S MolecularWeight: 465.56458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC=CO2)C#N)SCC(=O)NC(C)(C)C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC=CO2)C#N)SCC(=O)NC(C)(C)C)C3=CC=CC=C3

InChI

InChI=1S/C25H27N3O4S/c1-5-31-24(30)21-20(18-12-9-13-32-18)17(14-26)23(33-15-19(29)28-25(2,3)4)27-22(21)16-10-7-6-8-11-16/h6-13,20,27H,5,15H2,1-4H3,(H,28,29)