methyl 4-[2-methyl-4-(pyrimidin-2-ylamino)phenyl]benzoate

Systemtic Name: methyl 4-[2-methyl-4-(pyrimidin-2-ylamino)phenyl]benzoate Openeye Name: methyl 4-[2-methyl-4-(pyrimidin-2-ylamino)phenyl]benzoate CAS Name: 4-[2-methyl-4-(2-pyrimidinylamino)phenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[2-methyl-4-(pyrimidin-2-ylamino)phenyl]benzoate Traditional Name: 4-[2-methyl-4-(2-pyrimidylamino)phenyl]benzoic acid methyl ester Formula: C19H17N3O2 MolecularWeight: 319.35718

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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