2-[4-[(5-cyano-4-phenyl-pyrimidin-2-yl)amino]phenyl]ethanoic acid

Systemtic Name: 2-[4-[(5-cyano-4-phenyl-pyrimidin-2-yl)amino]phenyl]ethanoic acid Openeye Name: 2-[4-[(5-cyano-4-phenyl-pyrimidin-2-yl)amino]phenyl]acetic acid CAS Name: 2-[4-[(5-cyano-4-phenyl-2-pyrimidinyl)amino]phenyl]acetic acid IUPAC Name: 2-[4-[(5-cyano-4-phenylpyrimidin-2-yl)amino]phenyl]acetic acid Traditional Name: 2-[4-[(5-cyano-4-phenyl-pyrimidin-2-yl)amino]phenyl]acetic acid Formula: C19H14N4O2 MolecularWeight: 330.34006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NC=C2C#N)NC3=CC=C(C=C3)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NC=C2C#N)NC3=CC=C(C=C3)CC(=O)O

InChI

InChI=1S/C19H14N4O2/c20-11-15-12-21-19(23-18(15)14-4-2-1-3-5-14)22-16-8-6-13(7-9-16)10-17(24)25/h1-9,12H,10H2,(H,24,25)(H,21,22,23)