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

Systemtic Name: 4-[[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]methyl]benzoate Openeye Name: 4-[[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]methyl]benzoate CAS Name: 4-[[(2-methyl-6-phenyl-4-pyrimidinyl)amino]methyl]benzoate IUPAC Name: 4-[[(2-methyl-6-phenylpyrimidin-4-yl)amino]methyl]benzoate Traditional Name: 4-[[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]methyl]benzoate Formula: C19H16N3O2- MolecularWeight: 318.34924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NCC2=CC=C(C=C2)C(=O)[O-])C3=CC=CC=C3

Isomeric SMILES

CC1=NC(=CC(=N1)NCC2=CC=C(C=C2)C(=O)[O-])C3=CC=CC=C3

InChI

InChI=1S/C19H17N3O2/c1-13-21-17(15-5-3-2-4-6-15)11-18(22-13)20-12-14-7-9-16(10-8-14)19(23)24/h2-11H,12H2,1H3,(H,23,24)(H,20,21,22)/p-1