3-[2-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid

Systemtic Name: 3-[2-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-2-oxidanylidene-ethyl]sulfanylpropanoic acid Openeye Name: 3-[2-[(3-tert-butylisoxazol-5-yl)amino]-2-oxo-ethyl]sulfanylpropanoic acid CAS Name: 3-[[2-[(3-tert-butyl-5-isoxazolyl)amino]-2-oxoethyl]thio]propanoic acid IUPAC Name: 3-[2-[(3-tert-butyl-1,2-oxazol-5-yl)amino]-2-oxoethyl]sulfanylpropanoic acid Traditional Name: 3-[[2-[(3-tert-butylisoxazol-5-yl)amino]-2-keto-ethyl]thio]propionic acid Formula: C12H18N2O4S MolecularWeight: 286.34732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NOC(=C1)NC(=O)CSCCC(=O)O

Isomeric SMILES

CC(C)(C)C1=NOC(=C1)NC(=O)CSCCC(=O)O

InChI

InChI=1S/C12H18N2O4S/c1-12(2,3)8-6-10(18-14-8)13-9(15)7-19-5-4-11(16)17/h6H,4-5,7H2,1-3H3,(H,13,15)(H,16,17)