N4-(4-methoxyphenyl)-N6-phenethyl-1-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine

Systemtic Name: N4-(4-methoxyphenyl)-N6-phenethyl-1-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N4-(4-methoxyphenyl)-N6-phenethyl-1-phenyl-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: N4-(4-methoxyphenyl)-N6-phenethyl-1-phenylpyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N-(4-methoxyphenyl)-6-N-phenethyl-1-phenylpyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: (4-methoxyphenyl)-[6-(phenethylamino)-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C26H24N6O MolecularWeight: 436.50836

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NC(=NC3=C2C=NN3C4=CC=CC=C4)NCCC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NC(=NC3=C2C=NN3C4=CC=CC=C4)NCCC5=CC=CC=C5

InChI

InChI=1S/C26H24N6O/c1-33-22-14-12-20(13-15-22)29-24-23-18-28-32(21-10-6-3-7-11-21)25(23)31-26(30-24)27-17-16-19-8-4-2-5-9-19/h2-15,18H,16-17H2,1H3,(H2,27,29,30,31)