5-(4-ethoxyphenyl)-6-[(4-ethoxyphenyl)amino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-(4-ethoxyphenyl)-6-[(4-ethoxyphenyl)amino]-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 6-(4-ethoxyanilino)-5-(4-ethoxyphenyl)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 6-(4-ethoxyanilino)-5-(4-ethoxyphenyl)-1-phenyl-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 6-(4-ethoxyanilino)-5-(4-ethoxyphenyl)-1-phenylpyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-phenyl-6-(p-phenetidino)-5-p-phenetyl-pyrazolo[3,4-d]pyrimidin-4-one Formula: C27H25N5O3 MolecularWeight: 467.5191

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)NC2=NC3=C(C=NN3C4=CC=CC=C4)C(=O)N2C5=CC=C(C=C5)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)NC2=NC3=C(C=NN3C4=CC=CC=C4)C(=O)N2C5=CC=C(C=C5)OCC

InChI

InChI=1S/C27H25N5O3/c1-3-34-22-14-10-19(11-15-22)29-27-30-25-24(18-28-32(25)21-8-6-5-7-9-21)26(33)31(27)20-12-16-23(17-13-20)35-4-2/h5-18H,3-4H2,1-2H3,(H,29,30)