3-[5-[(4-propan-2-ylphenyl)amino]pyrazolo[1,5-a]pyrimidin-3-yl]benzoic acid

Systemtic Name: 3-[5-[(4-propan-2-ylphenyl)amino]pyrazolo[1,5-a]pyrimidin-3-yl]benzoic acid Openeye Name: 3-[5-(4-isopropylanilino)pyrazolo[1,5-a]pyrimidin-3-yl]benzoic acid CAS Name: 3-[5-(4-propan-2-ylanilino)-3-pyrazolo[1,5-a]pyrimidinyl]benzoic acid IUPAC Name: 3-[5-(4-propan-2-ylanilino)pyrazolo[1,5-a]pyrimidin-3-yl]benzoic acid Traditional Name: 3-(5-cumidinopyrazolo[1,5-a]pyrimidin-3-yl)benzoic acid Formula: C22H20N4O2 MolecularWeight: 372.4198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC2=NC3=C(C=NN3C=C2)C4=CC(=CC=C4)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC2=NC3=C(C=NN3C=C2)C4=CC(=CC=C4)C(=O)O

InChI

InChI=1S/C22H20N4O2/c1-14(2)15-6-8-18(9-7-15)24-20-10-11-26-21(25-20)19(13-23-26)16-4-3-5-17(12-16)22(27)28/h3-14H,1-2H3,(H,24,25)(H,27,28)