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

Systemtic Name: [3-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 3-methoxybenzoate Openeye Name: [3-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid [3-[(2-methyl-6-phenyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [3-[(2-methyl-6-phenylpyrimidin-4-yl)amino]phenyl] 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid [3-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] ester Formula: C25H21N3O3 MolecularWeight: 411.45254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NC2=CC(=CC=C2)OC(=O)C3=CC(=CC=C3)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=CC(=N1)NC2=CC(=CC=C2)OC(=O)C3=CC(=CC=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C25H21N3O3/c1-17-26-23(18-8-4-3-5-9-18)16-24(27-17)28-20-11-7-13-22(15-20)31-25(29)19-10-6-12-21(14-19)30-2/h3-16H,1-2H3,(H,26,27,28)