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

Systemtic Name: ethyl 2-[(6-phenylpyrimidin-4-yl)amino]benzoate Openeye Name: ethyl 2-[(6-phenylpyrimidin-4-yl)amino]benzoate CAS Name: 2-[(6-phenyl-4-pyrimidinyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[(6-phenylpyrimidin-4-yl)amino]benzoate Traditional Name: 2-[(6-phenylpyrimidin-4-yl)amino]benzoic acid ethyl ester Formula: C19H17N3O2 MolecularWeight: 319.35718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC2=NC=NC(=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC2=NC=NC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C19H17N3O2/c1-2-24-19(23)15-10-6-7-11-16(15)22-18-12-17(20-13-21-18)14-8-4-3-5-9-14/h3-13H,2H2,1H3,(H,20,21,22)