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

Systemtic Name: 2-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]ethanol Openeye Name: 2-[(5-phenylisoxazol-3-yl)methylsulfanyl]ethanol CAS Name: 2-[(5-phenyl-3-isoxazolyl)methylthio]ethanol IUPAC Name: 2-[(5-phenyl-1,2-oxazol-3-yl)methylsulfanyl]ethanol Traditional Name: 2-[(5-phenylisoxazol-3-yl)methylthio]ethanol Formula: C12H13NO2S MolecularWeight: 235.30212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NO2)CSCCO

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NO2)CSCCO

InChI

InChI=1S/C12H13NO2S/c14-6-7-16-9-11-8-12(15-13-11)10-4-2-1-3-5-10/h1-5,8,14H,6-7,9H2