tert-butyl (2S)-3-(2-methyl-6-oxidanylidene-1H-pyrimidin-5-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Systemtic Name: tert-butyl (2S)-3-(2-methyl-6-oxidanylidene-1H-pyrimidin-5-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Openeye Name: tert-butyl (2S)-2-(tert-butoxycarbonylamino)-3-(2-methyl-6-oxo-1H-pyrimidin-5-yl)propanoate CAS Name: (2S)-3-(2-methyl-6-oxo-1H-pyrimidin-5-yl)-2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]propanoic acid tert-butyl ester IUPAC Name: tert-butyl (2S)-3-(2-methyl-6-oxo-1H-pyrimidin-5-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate Traditional Name: (2S)-2-(tert-butoxycarbonylamino)-3-(6-keto-2-methyl-1H-pyrimidin-5-yl)propionic acid tert-butyl ester Formula: C17H27N3O5 MolecularWeight: 353.41338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C(=O)N1)CC(C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

Isomeric SMILES

CC1=NC=C(C(=O)N1)C[C@@H](C(=O)OC(C)(C)C)NC(=O)OC(C)(C)C

InChI

InChI=1S/C17H27N3O5/c1-10-18-9-11(13(21)19-10)8-12(14(22)24-16(2,3)4)20-15(23)25-17(5,6)7/h9,12H,8H2,1-7H3,(H,20,23)(H,18,19,21)/t12-/m0/s1