methyl 2-[(2-phenylazanylpyrimidin-4-yl)amino]benzoate

Systemtic Name: methyl 2-[(2-phenylazanylpyrimidin-4-yl)amino]benzoate Openeye Name: methyl 2-[(2-anilinopyrimidin-4-yl)amino]benzoate CAS Name: 2-[(2-anilino-4-pyrimidinyl)amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(2-anilinopyrimidin-4-yl)amino]benzoate Traditional Name: 2-[(2-anilinopyrimidin-4-yl)amino]benzoic acid methyl ester Formula: C18H16N4O2 MolecularWeight: 320.34524

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC2=NC(=NC=C2)NC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC2=NC(=NC=C2)NC3=CC=CC=C3

InChI

InChI=1S/C18H16N4O2/c1-24-17(23)14-9-5-6-10-15(14)21-16-11-12-19-18(22-16)20-13-7-3-2-4-8-13/h2-12H,1H3,(H2,19,20,21,22)