2-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[(3-ethyl-5-methyl-1,2-oxazol-4-yl)carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[(3-ethyl-5-methyl-isoxazole-4-carbonyl)amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[(3-ethyl-5-methyl-4-isoxazolyl)-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[(3-ethyl-5-methyl-1,2-oxazole-4-carbonyl)amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(3-ethyl-5-methyl-isoxazole-4-carbonyl)amino]-4-(methylthio)butyric acid Formula: C12H18N2O4S MolecularWeight: 286.34732

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NOC(=C1C(=O)NC(CCSC)C(=O)O)C

Isomeric SMILES

CCC1=NOC(=C1C(=O)NC(CCSC)C(=O)O)C

InChI

InChI=1S/C12H18N2O4S/c1-4-8-10(7(2)18-14-8)11(15)13-9(12(16)17)5-6-19-3/h9H,4-6H2,1-3H3,(H,13,15)(H,16,17)