(3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-phenylsulfanylpyridine-3-carboxylate

Systemtic Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-phenylsulfanylpyridine-3-carboxylate Openeye Name: (3,5-dimethylisoxazol-4-yl)methyl 2-phenylsulfanylpyridine-3-carboxylate CAS Name: 2-(phenylthio)-3-pyridinecarboxylic acid (3,5-dimethyl-4-isoxazolyl)methyl ester IUPAC Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 2-phenylsulfanylpyridine-3-carboxylate Traditional Name: 2-(phenylthio)nicotinic acid (3,5-dimethylisoxazol-4-yl)methyl ester Formula: C18H16N2O3S MolecularWeight: 340.39624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)COC(=O)C2=C(N=CC=C2)SC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NO1)C)COC(=O)C2=C(N=CC=C2)SC3=CC=CC=C3

InChI

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