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

Systemtic Name: ethyl 5-cyano-6-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-2-methyl-pyridine-3-carboxylate Openeye Name: ethyl 5-cyano-6-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-2-methyl-pyridine-3-carboxylate CAS Name: 5-cyano-6-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methylthio]-2-methyl-3-pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-2-methylpyridine-3-carboxylate Traditional Name: 5-cyano-6-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methylthio]-2-methyl-nicotinic acid ethyl ester Formula: C20H18N4O4S MolecularWeight: 410.44632

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC2=NC(=NO2)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CCOC(=O)C1=C(N=C(C(=C1)C#N)SCC2=NC(=NO2)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C20H18N4O4S/c1-4-27-20(25)16-9-14(10-21)19(22-12(16)2)29-11-17-23-18(24-28-17)13-5-7-15(26-3)8-6-13/h5-9H,4,11H2,1-3H3