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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=CC(=N2)NC3=CC=C(C=C3)C(=O)[O-])C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=CC(=N2)NC3=CC=C(C=C3)C(=O)[O-])C

InChI

InChI=1S/C19H17N3O2/c1-12-3-5-14(6-4-12)18-20-13(2)11-17(22-18)21-16-9-7-15(8-10-16)19(23)24/h3-11H,1-2H3,(H,23,24)(H,20,21,22)/p-1