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

Systemtic Name: 2-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]ethanoylamino]-3-oxidanyl-butanoic acid Openeye Name: 2-[[2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]acetyl]amino]-3-hydroxy-butanoic acid CAS Name: 2-[[2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-1-oxoethyl]amino]-3-hydroxybutanoic acid IUPAC Name: 2-[[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]acetyl]amino]-3-hydroxybutanoic acid Traditional Name: 2-[[2-[(3,5-dimethylisoxazol-4-yl)methylthio]acetyl]amino]-3-hydroxy-butyric acid Formula: C12H18N2O5S MolecularWeight: 302.34672

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O5S/c1-6-9(8(3)19-14-6)4-20-5-10(16)13-11(7(2)15)12(17)18/h7,11,15H,4-5H2,1-3H3,(H,13,16)(H,17,18)