methyl (2S)-3-(2-methyl-3-methylsulfanyl-5-oxidanylidene-1,2-oxazol-4-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: methyl (2S)-3-(2-methyl-3-methylsulfanyl-5-oxidanylidene-1,2-oxazol-4-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: methyl (2S)-2-(tert-butoxycarbonylamino)-3-(2-methyl-3-methylsulfanyl-5-oxo-isoxazol-4-yl)propanoate CAS Name: (2S)-3-[2-methyl-3-(methylthio)-5-oxo-4-isoxazolyl]-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(2-methyl-3-methylsulfanyl-5-oxo-1,2-oxazol-4-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-3-[5-keto-2-methyl-3-(methylthio)-3-isoxazolin-4-yl]propionic acid methyl ester Formula: C14H22N2O6S MolecularWeight: 346.39928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=C(N(OC1=O)C)SC)C(=O)OC

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H](CC1=C(N(OC1=O)C)SC)C(=O)OC

InChI

InChI=1S/C14H22N2O6S/c1-14(2,3)21-13(19)15-9(12(18)20-5)7-8-10(23-6)16(4)22-11(8)17/h9H,7H2,1-6H3,(H,15,19)/t9-/m0/s1