[3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl 2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoate

Systemtic Name: [3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl 2-(4,6-dimethylpyrimidin-2-yl)sulfanylethanoate Openeye Name: [3-(4-methoxyphenyl)isoxazol-5-yl]methyl 2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetate CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]acetic acid [3-(4-methoxyphenyl)-5-isoxazolyl]methyl ester IUPAC Name: [3-(4-methoxyphenyl)-1,2-oxazol-5-yl]methyl 2-(4,6-dimethylpyrimidin-2-yl)sulfanylacetate Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]acetic acid [3-(4-methoxyphenyl)isoxazol-5-yl]methyl ester Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SCC(=O)OCC2=CC(=NO2)C3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=CC(=NC(=N1)SCC(=O)OCC2=CC(=NO2)C3=CC=C(C=C3)OC)C

InChI

InChI=1S/C19H19N3O4S/c1-12-8-13(2)21-19(20-12)27-11-18(23)25-10-16-9-17(22-26-16)14-4-6-15(24-3)7-5-14/h4-9H,10-11H2,1-3H3