[2-tert-butyl-4-(pyrimidin-2-ylamino)phenyl] 3,3-dimethylbutanoate

Systemtic Name: [2-tert-butyl-4-(pyrimidin-2-ylamino)phenyl] 3,3-dimethylbutanoate Openeye Name: [2-tert-butyl-4-(pyrimidin-2-ylamino)phenyl] 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid [2-tert-butyl-4-(2-pyrimidinylamino)phenyl] ester IUPAC Name: [2-tert-butyl-4-(pyrimidin-2-ylamino)phenyl] 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid [2-tert-butyl-4-(2-pyrimidylamino)phenyl] ester Formula: C20H27N3O2 MolecularWeight: 341.44728

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)OC1=C(C=C(C=C1)NC2=NC=CC=N2)C(C)(C)C

Isomeric SMILES

CC(C)(C)CC(=O)OC1=C(C=C(C=C1)NC2=NC=CC=N2)C(C)(C)C

InChI

InChI=1S/C20H27N3O2/c1-19(2,3)13-17(24)25-16-9-8-14(12-15(16)20(4,5)6)23-18-21-10-7-11-22-18/h7-12H,13H2,1-6H3,(H,21,22,23)