(5-methyl-1,2-oxazol-3-yl)methyl 2-(4-methylphenyl)sulfanylpyridine-3-carboxylate

Systemtic Name: (5-methyl-1,2-oxazol-3-yl)methyl 2-(4-methylphenyl)sulfanylpyridine-3-carboxylate Openeye Name: (5-methylisoxazol-3-yl)methyl 2-(p-tolylsulfanyl)pyridine-3-carboxylate CAS Name: 2-[(4-methylphenyl)thio]-3-pyridinecarboxylic acid (5-methyl-3-isoxazolyl)methyl ester IUPAC Name: (5-methyl-1,2-oxazol-3-yl)methyl 2-(4-methylphenyl)sulfanylpyridine-3-carboxylate Traditional Name: 2-(p-tolylthio)nicotinic acid (5-methylisoxazol-3-yl)methyl ester Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=C(C=CC=N2)C(=O)OCC3=NOC(=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)SC2=C(C=CC=N2)C(=O)OCC3=NOC(=C3)C

InChI

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