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

Systemtic Name: 2-[(3-methyl-5-propan-2-yl-1,2-oxazol-4-yl)carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[(5-isopropyl-3-methyl-isoxazole-4-carbonyl)amino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[(3-methyl-5-propan-2-yl-4-isoxazolyl)-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[(3-methyl-5-propan-2-yl-1,2-oxazole-4-carbonyl)amino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[(5-isopropyl-3-methyl-isoxazole-4-carbonyl)amino]-4-(methylthio)butyric acid Formula: C13H20N2O4S MolecularWeight: 300.3739

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1C(=O)NC(CCSC)C(=O)O)C(C)C

Isomeric SMILES

CC1=NOC(=C1C(=O)NC(CCSC)C(=O)O)C(C)C

InChI

InChI=1S/C13H20N2O4S/c1-7(2)11-10(8(3)15-19-11)12(16)14-9(13(17)18)5-6-20-4/h7,9H,5-6H2,1-4H3,(H,14,16)(H,17,18)