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

Systemtic Name: ethyl 5-cyano-6-[[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-[[2-(2-methoxyphenyl)thiazol-4-yl]methylsulfanyl]-2-methyl-pyridine-3-carboxylate CAS Name: 5-cyano-6-[[2-(2-methoxyphenyl)-4-thiazolyl]methylthio]-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-[[2-(2-methoxyphenyl)-1,3-thiazol-4-yl]methylsulfanyl]-2-methylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[[2-(2-methoxyphenyl)thiazol-4-yl]methylthio]-2-methyl-nicotinic acid ethyl ester Formula: C21H19N3O3S2 MolecularWeight: 425.52386

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC2=CSC(=N2)C3=CC=CC=C3OC)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC2=CSC(=N2)C3=CC=CC=C3OC)C

InChI

InChI=1S/C21H19N3O3S2/c1-4-27-21(25)17-9-14(10-22)19(23-13(17)2)28-11-15-12-29-20(24-15)16-7-5-6-8-18(16)26-3/h5-9,12H,4,11H2,1-3H3