[4-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl] 2-methylquinoline-4-carboxylate

Systemtic Name: [4-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl] 2-methylquinoline-4-carboxylate Openeye Name: [4-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl] 2-methylquinoline-4-carboxylate CAS Name: 2-methyl-4-quinolinecarboxylic acid [4-[(4,6-dimethyl-2-pyrimidinyl)amino]phenyl] ester IUPAC Name: [4-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl] 2-methylquinoline-4-carboxylate Traditional Name: 2-methylcinchoninic acid [4-[(4,6-dimethylpyrimidin-2-yl)amino]phenyl] ester Formula: C23H20N4O2 MolecularWeight: 384.4305

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)OC(=O)C3=CC(=NC4=CC=CC=C43)C)C

Isomeric SMILES

CC1=CC(=NC(=N1)NC2=CC=C(C=C2)OC(=O)C3=CC(=NC4=CC=CC=C43)C)C

InChI

InChI=1S/C23H20N4O2/c1-14-12-15(2)26-23(25-14)27-17-8-10-18(11-9-17)29-22(28)20-13-16(3)24-21-7-5-4-6-19(20)21/h4-13H,1-3H3,(H,25,26,27)