2-[[2-[(3-ethanoylphenyl)amino]pyrimidin-4-yl]amino]benzoate

Systemtic Name: 2-[[2-[(3-ethanoylphenyl)amino]pyrimidin-4-yl]amino]benzoate Openeye Name: 2-[[2-(3-acetylanilino)pyrimidin-4-yl]amino]benzoate CAS Name: 2-[[2-(3-acetylanilino)-4-pyrimidinyl]amino]benzoate IUPAC Name: 2-[[2-(3-acetylanilino)pyrimidin-4-yl]amino]benzoate Traditional Name: 2-[[2-(3-acetylanilino)pyrimidin-4-yl]amino]benzoate Formula: C19H15N4O3- MolecularWeight: 347.3474

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC2=NC=CC(=N2)NC3=CC=CC=C3C(=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC2=NC=CC(=N2)NC3=CC=CC=C3C(=O)[O-]

InChI

InChI=1S/C19H16N4O3/c1-12(24)13-5-4-6-14(11-13)21-19-20-10-9-17(23-19)22-16-8-3-2-7-15(16)18(25)26/h2-11H,1H3,(H,25,26)(H2,20,21,22,23)/p-1