ethyl 5-cyano-6-[2-[(4-cyanophenyl)methoxy]-2-oxidanylidene-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate

Systemtic Name: ethyl 5-cyano-6-[2-[(4-cyanophenyl)methoxy]-2-oxidanylidene-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-[2-[(4-cyanophenyl)methoxy]-2-oxo-ethyl]sulfanyl-2-methyl-pyridine-3-carboxylate CAS Name: 5-cyano-6-[[2-[(4-cyanophenyl)methoxy]-2-oxoethyl]thio]-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-[2-[(4-cyanophenyl)methoxy]-2-oxoethyl]sulfanyl-2-methylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[[2-(4-cyanobenzyl)oxy-2-keto-ethyl]thio]-2-methyl-nicotinic acid ethyl ester Formula: C20H17N3O4S MolecularWeight: 395.43168

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC(=O)OCC2=CC=C(C=C2)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC(=O)OCC2=CC=C(C=C2)C#N)C

InChI

InChI=1S/C20H17N3O4S/c1-3-26-20(25)17-8-16(10-22)19(23-13(17)2)28-12-18(24)27-11-15-6-4-14(9-21)5-7-15/h4-8H,3,11-12H2,1-2H3