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

Systemtic Name: methyl 4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]benzoate Openeye Name: methyl 4-methyl-3-[[4-(3-pyridyl)pyrimidin-2-yl]amino]benzoate CAS Name: 4-methyl-3-[[4-(3-pyridinyl)-2-pyrimidinyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-methyl-3-[(4-pyridin-3-ylpyrimidin-2-yl)amino]benzoate Traditional Name: 4-methyl-3-[[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=C(C=C1)C(=O)OC)NC2=NC=CC(=N2)C3=CN=CC=C3

Isomeric SMILES

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

InChI

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