[3-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 2-methylpropanoate

Systemtic Name: [3-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 2-methylpropanoate Openeye Name: [3-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [3-[(2-methyl-6-phenyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [3-[(2-methyl-6-phenylpyrimidin-4-yl)amino]phenyl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [3-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] ester Formula: C21H21N3O2 MolecularWeight: 347.41034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NC2=CC(=CC=C2)OC(=O)C(C)C)C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=CC(=N1)NC2=CC(=CC=C2)OC(=O)C(C)C)C3=CC=CC=C3

InChI

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