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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3CC3)C(=O)NC4=NN(C=C4)CC5=CC=C(C=C5)Br)C

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3CC3)C(=O)NC4=NN(C=C4)CC5=CC=C(C=C5)Br)C

InChI

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