[4-[(6-phenylpyrimidin-4-yl)amino]phenyl] pyridine-3-carboxylate

Systemtic Name: [4-[(6-phenylpyrimidin-4-yl)amino]phenyl] pyridine-3-carboxylate Openeye Name: [4-[(6-phenylpyrimidin-4-yl)amino]phenyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [4-[(6-phenyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [4-[(6-phenylpyrimidin-4-yl)amino]phenyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [4-[(6-phenylpyrimidin-4-yl)amino]phenyl] ester Formula: C22H16N4O2 MolecularWeight: 368.38804

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NC=N2)NC3=CC=C(C=C3)OC(=O)C4=CN=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NC=N2)NC3=CC=C(C=C3)OC(=O)C4=CN=CC=C4

InChI

InChI=1S/C22H16N4O2/c27-22(17-7-4-12-23-14-17)28-19-10-8-18(9-11-19)26-21-13-20(24-15-25-21)16-5-2-1-3-6-16/h1-15H,(H,24,25,26)