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

Systemtic Name: 2-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]ethanoylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[[2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]acetyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-1-oxoethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]acetyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[[2-[(3,5-dimethylisoxazol-4-yl)methylthio]acetyl]amino]-4-(methylthio)butyric acid Formula: C13H20N2O4S2 MolecularWeight: 332.4389

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20N2O4S2/c1-8-10(9(2)19-15-8)6-21-7-12(16)14-11(13(17)18)4-5-20-3/h11H,4-7H2,1-3H3,(H,14,16)(H,17,18)