2-[[3-(4-methylphenyl)-1,2-oxazol-5-yl]methylsulfanyl]ethanol

Systemtic Name: 2-[[3-(4-methylphenyl)-1,2-oxazol-5-yl]methylsulfanyl]ethanol Openeye Name: 2-[[3-(p-tolyl)isoxazol-5-yl]methylsulfanyl]ethanol CAS Name: 2-[[3-(4-methylphenyl)-5-isoxazolyl]methylthio]ethanol IUPAC Name: 2-[[3-(4-methylphenyl)-1,2-oxazol-5-yl]methylsulfanyl]ethanol Traditional Name: 2-[[3-(p-tolyl)isoxazol-5-yl]methylthio]ethanol Formula: C13H15NO2S MolecularWeight: 249.3287

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NOC(=C2)CSCCO

Isomeric SMILES

CC1=CC=C(C=C1)C2=NOC(=C2)CSCCO

InChI

InChI=1S/C13H15NO2S/c1-10-2-4-11(5-3-10)13-8-12(16-14-13)9-17-7-6-15/h2-5,8,15H,6-7,9H2,1H3