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

Systemtic Name: ethyl 4-[(2,6-diphenylpyrimidin-4-yl)amino]benzoate Openeye Name: ethyl 4-[(2,6-diphenylpyrimidin-4-yl)amino]benzoate CAS Name: 4-[(2,6-diphenyl-4-pyrimidinyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2,6-diphenylpyrimidin-4-yl)amino]benzoate Traditional Name: 4-[(2,6-diphenylpyrimidin-4-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=C(C=C1)NC2=NC(=NC(=C2)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC2=NC(=NC(=C2)C3=CC=CC=C3)C4=CC=CC=C4

InChI

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