2-(3-methyl-1,2-oxazol-5-yl)-2-methylsulfanyl-1-phenyl-ethanol

Systemtic Name: 2-(3-methyl-1,2-oxazol-5-yl)-2-methylsulfanyl-1-phenyl-ethanol Openeye Name: 2-(3-methylisoxazol-5-yl)-2-methylsulfanyl-1-phenyl-ethanol CAS Name: 2-(3-methyl-5-isoxazolyl)-2-(methylthio)-1-phenylethanol IUPAC Name: 2-(3-methyl-1,2-oxazol-5-yl)-2-methylsulfanyl-1-phenylethanol Traditional Name: 2-(3-methylisoxazol-5-yl)-2-(methylthio)-1-phenyl-ethanol Formula: C13H15NO2S MolecularWeight: 249.3287

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)C(C(C2=CC=CC=C2)O)SC

Isomeric SMILES

CC1=NOC(=C1)C(C(C2=CC=CC=C2)O)SC

InChI

InChI=1S/C13H15NO2S/c1-9-8-11(16-14-9)13(17-2)12(15)10-6-4-3-5-7-10/h3-8,12-13,15H,1-2H3