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

Systemtic Name: (5-methyl-1,2-oxazol-3-yl)methyl 2-(3,4-dimethylphenyl)sulfanylpyridine-3-carboxylate Openeye Name: (5-methylisoxazol-3-yl)methyl 2-(3,4-dimethylphenyl)sulfanylpyridine-3-carboxylate CAS Name: 2-[(3,4-dimethylphenyl)thio]-3-pyridinecarboxylic acid (5-methyl-3-isoxazolyl)methyl ester IUPAC Name: (5-methyl-1,2-oxazol-3-yl)methyl 2-(3,4-dimethylphenyl)sulfanylpyridine-3-carboxylate Traditional Name: 2-[(3,4-dimethylphenyl)thio]nicotinic acid (5-methylisoxazol-3-yl)methyl ester Formula: C19H18N2O3S MolecularWeight: 354.42282

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H18N2O3S/c1-12-6-7-16(9-13(12)2)25-18-17(5-4-8-20-18)19(22)23-11-15-10-14(3)24-21-15/h4-10H,11H2,1-3H3