[4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 6-oxidanylidene-1H-pyridazine-3-carboxylate

Systemtic Name: [4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 6-oxidanylidene-1H-pyridazine-3-carboxylate Openeye Name: [4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] 6-oxo-1H-pyridazine-3-carboxylate CAS Name: 6-oxo-1H-pyridazine-3-carboxylic acid [4-[(2-methyl-6-phenyl-4-pyrimidinyl)amino]phenyl] ester IUPAC Name: [4-[(2-methyl-6-phenylpyrimidin-4-yl)amino]phenyl] 6-oxo-1H-pyridazine-3-carboxylate Traditional Name: 6-keto-1H-pyridazine-3-carboxylic acid [4-[(2-methyl-6-phenyl-pyrimidin-4-yl)amino]phenyl] ester Formula: C22H17N5O3 MolecularWeight: 399.40208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)OC(=O)C3=NNC(=O)C=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=CC(=N1)NC2=CC=C(C=C2)OC(=O)C3=NNC(=O)C=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H17N5O3/c1-14-23-19(15-5-3-2-4-6-15)13-20(24-14)25-16-7-9-17(10-8-16)30-22(29)18-11-12-21(28)27-26-18/h2-13H,1H3,(H,27,28)(H,23,24,25)