4-[[6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]amino]benzoate

Systemtic Name: 4-[[6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]amino]benzoate Openeye Name: 4-[[6-methyl-2-(m-tolyl)pyrimidin-4-yl]amino]benzoate CAS Name: 4-[[6-methyl-2-(3-methylphenyl)-4-pyrimidinyl]amino]benzoate IUPAC Name: 4-[[6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]amino]benzoate Traditional Name: 4-[[6-methyl-2-(m-tolyl)pyrimidin-4-yl]amino]benzoate Formula: C19H16N3O2- MolecularWeight: 318.34924

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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