3-methyl-2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-1,2-thiazolidin-2-yl]butanoic acid

Systemtic Name: 3-methyl-2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxidanylidene-1,2-thiazolidin-2-yl]butanoic acid Openeye Name: 2-[4-(tert-butoxycarbonylamino)-3-oxo-isothiazolidin-2-yl]-3-methyl-butanoic acid CAS Name: 3-methyl-2-[4-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-3-oxo-2-isothiazolidinyl]butanoic acid IUPAC Name: 3-methyl-2-[4-[(2-methylpropan-2-yl)oxycarbonylamino]-3-oxo-1,2-thiazolidin-2-yl]butanoic acid Traditional Name: 2-[4-(tert-butoxycarbonylamino)-3-keto-isothiazolidin-2-yl]-3-methyl-butyric acid Formula: C13H22N2O5S MolecularWeight: 318.38918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)N1C(=O)C(CS1)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)C(C(=O)O)N1C(=O)C(CS1)NC(=O)OC(C)(C)C

InChI

InChI=1S/C13H22N2O5S/c1-7(2)9(11(17)18)15-10(16)8(6-21-15)14-12(19)20-13(3,4)5/h7-9H,6H2,1-5H3,(H,14,19)(H,17,18)