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

Systemtic Name: [5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methyl 2-methylsulfanylpyridine-3-carboxylate Openeye Name: [5-(4-fluorophenyl)-4-methyl-isoxazol-3-yl]methyl 2-methylsulfanylpyridine-3-carboxylate CAS Name: 2-(methylthio)-3-pyridinecarboxylic acid [5-(4-fluorophenyl)-4-methyl-3-isoxazolyl]methyl ester IUPAC Name: [5-(4-fluorophenyl)-4-methyl-1,2-oxazol-3-yl]methyl 2-methylsulfanylpyridine-3-carboxylate Traditional Name: 2-(methylthio)nicotinic acid [5-(4-fluorophenyl)-4-methyl-isoxazol-3-yl]methyl ester Formula: C18H15FN2O3S MolecularWeight: 358.386703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(ON=C1COC(=O)C2=C(N=CC=C2)SC)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=C(ON=C1COC(=O)C2=C(N=CC=C2)SC)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H15FN2O3S/c1-11-15(21-24-16(11)12-5-7-13(19)8-6-12)10-23-18(22)14-4-3-9-20-17(14)25-2/h3-9H,10H2,1-2H3