2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]ethanoic acid

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]ethanoic acid Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]acetic acid CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]acetic acid IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]acetic acid Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]acetic acid Formula: C8H11NO3S MolecularWeight: 201.24284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSCC(=O)O

Isomeric SMILES

CC1=C(C(=NO1)C)CSCC(=O)O

InChI

InChI=1S/C8H11NO3S/c1-5-7(6(2)12-9-5)3-13-4-8(10)11/h3-4H2,1-2H3,(H,10,11)