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

Systemtic Name: ethyl 5-cyano-6-[2-[(4-ethanoylphenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-(furan-2-yl)-2-phenyl-1,4-dihydropyridine-3-carboxylate Openeye Name: ethyl 6-[2-(4-acetylanilino)-2-oxo-ethyl]sulfanyl-5-cyano-4-(2-furyl)-2-phenyl-1,4-dihydropyridine-3-carboxylate CAS Name: 6-[[2-(4-acetylanilino)-2-oxoethyl]thio]-5-cyano-4-(2-furanyl)-2-phenyl-1,4-dihydropyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[2-(4-acetylanilino)-2-oxoethyl]sulfanyl-5-cyano-4-(furan-2-yl)-2-phenyl-1,4-dihydropyridine-3-carboxylate Traditional Name: 6-[[2-(4-acetylanilino)-2-keto-ethyl]thio]-5-cyano-4-(2-furyl)-2-phenyl-1,4-dihydropyridine-3-carboxylic acid ethyl ester Formula: C29H25N3O5S MolecularWeight: 527.5909

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1C2=CC=CO2)C#N)SCC(=O)NC3=CC=C(C=C3)C(=O)C)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC=CO2)C#N)SCC(=O)NC3=CC=C(C=C3)C(=O)C)C4=CC=CC=C4

InChI

InChI=1S/C29H25N3O5S/c1-3-36-29(35)26-25(23-10-7-15-37-23)22(16-30)28(32-27(26)20-8-5-4-6-9-20)38-17-24(34)31-21-13-11-19(12-14-21)18(2)33/h4-15,25,32H,3,17H2,1-2H3,(H,31,34)