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

Systemtic Name: 3-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]ethanoylamino]propanoic acid Openeye Name: 3-[[2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]acetyl]amino]propanoic acid CAS Name: 3-[[2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-1-oxoethyl]amino]propanoic acid IUPAC Name: 3-[[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]acetyl]amino]propanoic acid Traditional Name: 3-[[2-[(3,5-dimethylisoxazol-4-yl)methylthio]acetyl]amino]propionic acid Formula: C11H16N2O4S MolecularWeight: 272.32074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16N2O4S/c1-7-9(8(2)17-13-7)5-18-6-10(14)12-4-3-11(15)16/h3-6H2,1-2H3,(H,12,14)(H,15,16)