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

Systemtic Name: N-[4-[(4-bromanylpyrazol-1-yl)methyl]phenyl]-6-cyclopropyl-1,3-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-[4-[(4-bromopyrazol-1-yl)methyl]phenyl]-6-cyclopropyl-1,3-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-[4-[(4-bromo-1-pyrazolyl)methyl]phenyl]-6-cyclopropyl-1,3-dimethyl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-[4-[(4-bromopyrazol-1-yl)methyl]phenyl]-6-cyclopropyl-1,3-dimethylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-[4-[(4-bromopyrazol-1-yl)methyl]phenyl]-6-cyclopropyl-1,3-dimethyl-pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C22H21BrN6O MolecularWeight: 465.34574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3CC3)C(=O)NC4=CC=C(C=C4)CN5C=C(C=N5)Br)C

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3CC3)C(=O)NC4=CC=C(C=C4)CN5C=C(C=N5)Br)C

InChI

InChI=1S/C22H21BrN6O/c1-13-20-18(9-19(15-5-6-15)26-21(20)28(2)27-13)22(30)25-17-7-3-14(4-8-17)11-29-12-16(23)10-24-29/h3-4,7-10,12,15H,5-6,11H2,1-2H3,(H,25,30)