tert-butyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(6-oxidanylidene-2-phenyl-1H-pyrimidin-5-yl)butanoate

Systemtic Name: tert-butyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(6-oxidanylidene-2-phenyl-1H-pyrimidin-5-yl)butanoate Openeye Name: tert-butyl 2-(tert-butoxycarbonylamino)-4-(6-oxo-2-phenyl-1H-pyrimidin-5-yl)butanoate CAS Name: 2-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-4-(6-oxo-2-phenyl-1H-pyrimidin-5-yl)butanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(2-methylpropan-2-yl)oxycarbonylamino]-4-(6-oxo-2-phenyl-1H-pyrimidin-5-yl)butanoate Traditional Name: 2-(tert-butoxycarbonylamino)-4-(6-keto-2-phenyl-1H-pyrimidin-5-yl)butyric acid tert-butyl ester Formula: C23H31N3O5 MolecularWeight: 429.50934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(CCC1=CN=C(NC1=O)C2=CC=CC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)C(CCC1=CN=C(NC1=O)C2=CC=CC=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C23H31N3O5/c1-22(2,3)30-20(28)17(25-21(29)31-23(4,5)6)13-12-16-14-24-18(26-19(16)27)15-10-8-7-9-11-15/h7-11,14,17H,12-13H2,1-6H3,(H,25,29)(H,24,26,27)