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

Systemtic Name: 2-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]ethanoylamino]pentanoic acid Openeye Name: 2-[[2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]acetyl]amino]pentanoic acid CAS Name: 2-[[2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-1-oxoethyl]amino]pentanoic acid IUPAC Name: 2-[[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]acetyl]amino]pentanoic acid Traditional Name: 2-[[2-[(3,5-dimethylisoxazol-4-yl)methylthio]acetyl]amino]valeric acid Formula: C13H20N2O4S MolecularWeight: 300.3739

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)O)NC(=O)CSCC1=C(ON=C1C)C

Isomeric SMILES

CCCC(C(=O)O)NC(=O)CSCC1=C(ON=C1C)C

InChI

InChI=1S/C13H20N2O4S/c1-4-5-11(13(17)18)14-12(16)7-20-6-10-8(2)15-19-9(10)3/h11H,4-7H2,1-3H3,(H,14,16)(H,17,18)