[3-[(6-phenylpyrimidin-4-yl)amino]phenyl] 2,2-dimethylpropanoate

Systemtic Name: [3-[(6-phenylpyrimidin-4-yl)amino]phenyl] 2,2-dimethylpropanoate Openeye Name: [3-[(6-phenylpyrimidin-4-yl)amino]phenyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [3-[(6-phenyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [3-[(6-phenylpyrimidin-4-yl)amino]phenyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [3-[(6-phenylpyrimidin-4-yl)amino]phenyl] ester Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1=CC=CC(=C1)NC2=NC=NC(=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C(=O)OC1=CC=CC(=C1)NC2=NC=NC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H21N3O2/c1-21(2,3)20(25)26-17-11-7-10-16(12-17)24-19-13-18(22-14-23-19)15-8-5-4-6-9-15/h4-14H,1-3H3,(H,22,23,24)