N-(4-bromanyl-2-methyl-phenyl)-3,6-dimethyl-1-(phenylmethyl)pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-3,6-dimethyl-1-(phenylmethyl)pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: 1-benzyl-N-(4-bromo-2-methyl-phenyl)-3,6-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-(4-bromo-2-methylphenyl)-3,6-dimethyl-1-(phenylmethyl)-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1-benzyl-N-(4-bromo-2-methylphenyl)-3,6-dimethylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: 1-benzyl-N-(4-bromo-2-methyl-phenyl)-3,6-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C23H21BrN4O MolecularWeight: 449.34304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C2=CC(=NC3=C2C(=NN3CC4=CC=CC=C4)C)C

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C2=CC(=NC3=C2C(=NN3CC4=CC=CC=C4)C)C

InChI

InChI=1S/C23H21BrN4O/c1-14-11-18(24)9-10-20(14)26-23(29)19-12-15(2)25-22-21(19)16(3)27-28(22)13-17-7-5-4-6-8-17/h4-12H,13H2,1-3H3,(H,26,29)