[(2S)-1-oxidanylidene-1-(pyrimidin-2-ylamino)propan-2-yl] (2R)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylate

Systemtic Name: [(2S)-1-oxidanylidene-1-(pyrimidin-2-ylamino)propan-2-yl] (2R)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylate Openeye Name: [(1S)-1-methyl-2-oxo-2-(pyrimidin-2-ylamino)ethyl] (2R)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylate CAS Name: (2R)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [(2S)-1-oxo-1-(2-pyrimidinylamino)propan-2-yl] ester IUPAC Name: [(2S)-1-oxo-1-(pyrimidin-2-ylamino)propan-2-yl] (2R)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylate Traditional Name: (2R)-2-tert-butyl-1,2,3,4-tetrahydroacridine-9-carboxylic acid [(1S)-2-keto-1-methyl-2-(2-pyrimidylamino)ethyl] ester Formula: C25H28N4O3 MolecularWeight: 432.51482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC=CC=N1)OC(=O)C2=C3CC(CCC3=NC4=CC=CC=C42)C(C)(C)C

Isomeric SMILES

C[C@@H](C(=O)NC1=NC=CC=N1)OC(=O)C2=C3C[C@@H](CCC3=NC4=CC=CC=C42)C(C)(C)C

InChI

InChI=1S/C25H28N4O3/c1-15(22(30)29-24-26-12-7-13-27-24)32-23(31)21-17-8-5-6-9-19(17)28-20-11-10-16(14-18(20)21)25(2,3)4/h5-9,12-13,15-16H,10-11,14H2,1-4H3,(H,26,27,29,30)/t15-,16+/m0/s1