ethyl 3-[(4,6-diphenylpyrimidin-2-yl)amino]benzoate

Systemtic Name: ethyl 3-[(4,6-diphenylpyrimidin-2-yl)amino]benzoate Openeye Name: ethyl 3-[(4,6-diphenylpyrimidin-2-yl)amino]benzoate CAS Name: 3-[(4,6-diphenyl-2-pyrimidinyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[(4,6-diphenylpyrimidin-2-yl)amino]benzoate Traditional Name: 3-[(4,6-diphenylpyrimidin-2-yl)amino]benzoic acid ethyl ester Formula: C25H21N3O2 MolecularWeight: 395.45314

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)NC2=NC(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)NC2=NC(=CC(=N2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H21N3O2/c1-2-30-24(29)20-14-9-15-21(16-20)26-25-27-22(18-10-5-3-6-11-18)17-23(28-25)19-12-7-4-8-13-19/h3-17H,2H2,1H3,(H,26,27,28)