N-[4-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-3,6-dimethyl-1-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: N-[4-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-3,6-dimethyl-1-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-[4-[(4-bromopyrazol-1-yl)methyl]phenyl]-3,6-dimethyl-1-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-[4-[(4-bromo-1-pyrazolyl)methyl]phenyl]-3,6-dimethyl-1-phenyl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-[4-[(4-bromopyrazol-1-yl)methyl]phenyl]-3,6-dimethyl-1-phenylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-[4-[(4-bromopyrazol-1-yl)methyl]phenyl]-3,6-dimethyl-1-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C25H21BrN6O MolecularWeight: 501.37784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2C3=CC=CC=C3)C)C(=C1)C(=O)NC4=CC=C(C=C4)CN5C=C(C=N5)Br

Isomeric SMILES

CC1=NC2=C(C(=NN2C3=CC=CC=C3)C)C(=C1)C(=O)NC4=CC=C(C=C4)CN5C=C(C=N5)Br

InChI

InChI=1S/C25H21BrN6O/c1-16-12-22(23-17(2)30-32(24(23)28-16)21-6-4-3-5-7-21)25(33)29-20-10-8-18(9-11-20)14-31-15-19(26)13-27-31/h3-13,15H,14H2,1-2H3,(H,29,33)