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

Systemtic Name: 2-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[3-(3,5-dimethylisoxazol-4-yl)propanoylamino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[3-(3,5-dimethyl-4-isoxazolyl)-1-oxopropyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[3-(3,5-dimethyl-1,2-oxazol-4-yl)propanoylamino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[3-(3,5-dimethylisoxazol-4-yl)propanoylamino]-4-(methylthio)butyric acid Formula: C13H20N2O4S MolecularWeight: 300.3739

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CCC(=O)NC(CCSC)C(=O)O

Isomeric SMILES

CC1=C(C(=NO1)C)CCC(=O)NC(CCSC)C(=O)O

InChI

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