[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl 2-(2,4-dimethylphenyl)sulfanylethanoate

Systemtic Name: [5-(furan-2-yl)-1,2-oxazol-3-yl]methyl 2-(2,4-dimethylphenyl)sulfanylethanoate Openeye Name: [5-(2-furyl)isoxazol-3-yl]methyl 2-(2,4-dimethylphenyl)sulfanylacetate CAS Name: 2-[(2,4-dimethylphenyl)thio]acetic acid [5-(2-furanyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(furan-2-yl)-1,2-oxazol-3-yl]methyl 2-(2,4-dimethylphenyl)sulfanylacetate Traditional Name: 2-[(2,4-dimethylphenyl)thio]acetic acid [5-(2-furyl)isoxazol-3-yl]methyl ester Formula: C18H17NO4S MolecularWeight: 343.39688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCC(=O)OCC2=NOC(=C2)C3=CC=CO3)C

Isomeric SMILES

CC1=CC(=C(C=C1)SCC(=O)OCC2=NOC(=C2)C3=CC=CO3)C

InChI

InChI=1S/C18H17NO4S/c1-12-5-6-17(13(2)8-12)24-11-18(20)22-10-14-9-16(23-19-14)15-4-3-7-21-15/h3-9H,10-11H2,1-2H3