N-(4-bromanyl-3-methyl-phenyl)-3-methyl-1,6-diphenyl-pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-3-methyl-1,6-diphenyl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-3-methyl-1,6-diphenyl-pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-(4-bromo-3-methylphenyl)-3-methyl-1,6-diphenyl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-(4-bromo-3-methylphenyl)-3-methyl-1,6-diphenylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-3-methyl-1,6-diphenyl-pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C27H21BrN4O MolecularWeight: 497.38584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)C2=CC(=NC3=C2C(=NN3C4=CC=CC=C4)C)C5=CC=CC=C5)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)C2=CC(=NC3=C2C(=NN3C4=CC=CC=C4)C)C5=CC=CC=C5)Br

InChI

InChI=1S/C27H21BrN4O/c1-17-15-20(13-14-23(17)28)29-27(33)22-16-24(19-9-5-3-6-10-19)30-26-25(22)18(2)31-32(26)21-11-7-4-8-12-21/h3-16H,1-2H3,(H,29,33)