2-[2-methyl-4-[[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]amino]phenyl]ethanoic acid

Systemtic Name: 2-[2-methyl-4-[[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]amino]phenyl]ethanoic acid Openeye Name: 2-[2-methyl-4-[[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]amino]phenyl]acetic acid CAS Name: 2-[2-methyl-4-[[4-[(5-methyl-1H-pyrazol-3-yl)amino]-2-quinazolinyl]amino]phenyl]acetic acid IUPAC Name: 2-[2-methyl-4-[[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]amino]phenyl]acetic acid Traditional Name: 2-[2-methyl-4-[[4-[(5-methyl-1H-pyrazol-3-yl)amino]quinazolin-2-yl]amino]phenyl]acetic acid Formula: C21H20N6O2 MolecularWeight: 388.4225

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1)NC2=NC(=NC3=CC=CC=C32)NC4=CC(=C(C=C4)CC(=O)O)C

Isomeric SMILES

CC1=CC(=NN1)NC2=NC(=NC3=CC=CC=C32)NC4=CC(=C(C=C4)CC(=O)O)C

InChI

InChI=1S/C21H20N6O2/c1-12-9-15(8-7-14(12)11-19(28)29)22-21-23-17-6-4-3-5-16(17)20(25-21)24-18-10-13(2)26-27-18/h3-10H,11H2,1-2H3,(H,28,29)(H3,22,23,24,25,26,27)