ethyl 6-[[2-[(4-chloranylphenoxy)methyl]-1,3-thiazol-4-yl]methylsulfanyl]-5-cyano-2-methyl-pyridine-3-carboxylate

Systemtic Name: ethyl 6-[[2-[(4-chloranylphenoxy)methyl]-1,3-thiazol-4-yl]methylsulfanyl]-5-cyano-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 6-[[2-[(4-chlorophenoxy)methyl]thiazol-4-yl]methylsulfanyl]-5-cyano-2-methyl-pyridine-3-carboxylate CAS Name: 6-[[2-[(4-chlorophenoxy)methyl]-4-thiazolyl]methylthio]-5-cyano-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[[2-[(4-chlorophenoxy)methyl]-1,3-thiazol-4-yl]methylsulfanyl]-5-cyano-2-methylpyridine-3-carboxylate Traditional Name: 6-[[2-[(4-chlorophenoxy)methyl]thiazol-4-yl]methylthio]-5-cyano-2-methyl-nicotinic acid ethyl ester Formula: C21H18ClN3O3S2 MolecularWeight: 459.96892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC2=CSC(=N2)COC3=CC=C(C=C3)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC2=CSC(=N2)COC3=CC=C(C=C3)Cl)C

InChI

InChI=1S/C21H18ClN3O3S2/c1-3-27-21(26)18-8-14(9-23)20(24-13(18)2)30-12-16-11-29-19(25-16)10-28-17-6-4-15(22)5-7-17/h4-8,11H,3,10,12H2,1-2H3