6-(4-bromophenyl)-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-3-amine

Systemtic Name: 6-(4-bromophenyl)-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-3-amine Openeye Name: 6-(4-bromophenyl)-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-3-amine CAS Name: 6-(4-bromophenyl)-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-3-amine IUPAC Name: 6-(4-bromophenyl)-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-3-amine Traditional Name: [6-(4-bromophenyl)-4-(3,4,5-trimethoxyphenyl)-2H-pyrazolo[3,4-b]pyridin-3-yl]amine Formula: C21H19BrN4O3 MolecularWeight: 455.30456

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=CC(=NC3=NNC(=C23)N)C4=CC=C(C=C4)Br

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=CC(=NC3=NNC(=C23)N)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H19BrN4O3/c1-27-16-8-12(9-17(28-2)19(16)29-3)14-10-15(11-4-6-13(22)7-5-11)24-21-18(14)20(23)25-26-21/h4-10H,1-3H3,(H3,23,24,25,26)