methyl 3-methyl-4-[(4-pyridin-3-ylpyrimidin-2-yl)amino]benzoate

Systemtic Name: methyl 3-methyl-4-[(4-pyridin-3-ylpyrimidin-2-yl)amino]benzoate Openeye Name: methyl 3-methyl-4-[[4-(3-pyridyl)pyrimidin-2-yl]amino]benzoate CAS Name: 3-methyl-4-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid methyl ester IUPAC Name: methyl 3-methyl-4-[(4-pyridin-3-ylpyrimidin-2-yl)amino]benzoate Traditional Name: 3-methyl-4-[[4-(3-pyridyl)pyrimidin-2-yl]amino]benzoic acid methyl ester Formula: C18H16N4O2 MolecularWeight: 320.34524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)OC)NC2=NC=CC(=N2)C3=CN=CC=C3

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)OC)NC2=NC=CC(=N2)C3=CN=CC=C3

InChI

InChI=1S/C18H16N4O2/c1-12-10-13(17(23)24-2)5-6-15(12)21-18-20-9-7-16(22-18)14-4-3-8-19-11-14/h3-11H,1-2H3,(H,20,21,22)