[5-(4-methylphenyl)-1,2-oxazol-3-yl]methyl 2-methylsulfanylpyridine-3-carboxylate

Systemtic Name: [5-(4-methylphenyl)-1,2-oxazol-3-yl]methyl 2-methylsulfanylpyridine-3-carboxylate Openeye Name: [5-(p-tolyl)isoxazol-3-yl]methyl 2-methylsulfanylpyridine-3-carboxylate CAS Name: 2-(methylthio)-3-pyridinecarboxylic acid [5-(4-methylphenyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(4-methylphenyl)-1,2-oxazol-3-yl]methyl 2-methylsulfanylpyridine-3-carboxylate Traditional Name: 2-(methylthio)nicotinic acid [5-(p-tolyl)isoxazol-3-yl]methyl ester Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NO2)COC(=O)C3=C(N=CC=C3)SC

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NO2)COC(=O)C3=C(N=CC=C3)SC

InChI

InChI=1S/C18H16N2O3S/c1-12-5-7-13(8-6-12)16-10-14(20-23-16)11-22-18(21)15-4-3-9-19-17(15)24-2/h3-10H,11H2,1-2H3