methyl 4-[5-[(4-phenoxyphenyl)amino]pyrazolo[1,5-a]pyrimidin-3-yl]benzoate

Systemtic Name: methyl 4-[5-[(4-phenoxyphenyl)amino]pyrazolo[1,5-a]pyrimidin-3-yl]benzoate Openeye Name: methyl 4-[5-(4-phenoxyanilino)pyrazolo[1,5-a]pyrimidin-3-yl]benzoate CAS Name: 4-[5-(4-phenoxyanilino)-3-pyrazolo[1,5-a]pyrimidinyl]benzoic acid methyl ester IUPAC Name: methyl 4-[5-(4-phenoxyanilino)pyrazolo[1,5-a]pyrimidin-3-yl]benzoate Traditional Name: 4-[5-(4-phenoxyanilino)pyrazolo[1,5-a]pyrimidin-3-yl]benzoic acid methyl ester Formula: C26H20N4O3 MolecularWeight: 436.462

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C2=C3N=C(C=CN3N=C2)NC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C2=C3N=C(C=CN3N=C2)NC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C26H20N4O3/c1-32-26(31)19-9-7-18(8-10-19)23-17-27-30-16-15-24(29-25(23)30)28-20-11-13-22(14-12-20)33-21-5-3-2-4-6-21/h2-17H,1H3,(H,28,29)