5-phenyl-2-[(phenylmethyl)amino]pyrimidine-4-carboxylic acid

Systemtic Name: 5-phenyl-2-[(phenylmethyl)amino]pyrimidine-4-carboxylic acid Openeye Name: 2-(benzylamino)-5-phenyl-pyrimidine-4-carboxylic acid CAS Name: 5-phenyl-2-[(phenylmethyl)amino]-4-pyrimidinecarboxylic acid IUPAC Name: 2-(benzylamino)-5-phenylpyrimidine-4-carboxylic acid Traditional Name: 2-(benzylamino)-5-phenyl-pyrimidine-4-carboxylic acid Formula: C18H15N3O2 MolecularWeight: 305.3306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC=C(C(=N2)C(=O)O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC=C(C(=N2)C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C18H15N3O2/c22-17(23)16-15(14-9-5-2-6-10-14)12-20-18(21-16)19-11-13-7-3-1-4-8-13/h1-10,12H,11H2,(H,22,23)(H,19,20,21)