ethyl 6-[[5-(3-chlorophenyl)-1,3-oxazol-2-yl]methylsulfanyl]-5-cyano-2-methyl-pyridine-3-carboxylate

Systemtic Name: ethyl 6-[[5-(3-chlorophenyl)-1,3-oxazol-2-yl]methylsulfanyl]-5-cyano-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 6-[[5-(3-chlorophenyl)oxazol-2-yl]methylsulfanyl]-5-cyano-2-methyl-pyridine-3-carboxylate CAS Name: 6-[[5-(3-chlorophenyl)-2-oxazolyl]methylthio]-5-cyano-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-[[5-(3-chlorophenyl)-1,3-oxazol-2-yl]methylsulfanyl]-5-cyano-2-methylpyridine-3-carboxylate Traditional Name: 6-[[5-(3-chlorophenyl)oxazol-2-yl]methylthio]-5-cyano-2-methyl-nicotinic acid ethyl ester Formula: C20H16ClN3O3S MolecularWeight: 413.87734

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC2=NC=C(O2)C3=CC(=CC=C3)Cl)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC2=NC=C(O2)C3=CC(=CC=C3)Cl)C

InChI

InChI=1S/C20H16ClN3O3S/c1-3-26-20(25)16-8-14(9-22)19(24-12(16)2)28-11-18-23-10-17(27-18)13-5-4-6-15(21)7-13/h4-8,10H,3,11H2,1-2H3