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

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-1-butyl-6-cyclopropyl-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-1-butyl-6-cyclopropyl-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-(4-bromo-2-methylphenyl)-1-butyl-6-cyclopropyl-3-methyl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-(4-bromo-2-methylphenyl)-1-butyl-6-cyclopropyl-3-methylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-1-butyl-6-cyclopropyl-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C22H25BrN4O MolecularWeight: 441.3641

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=N1)C)C(=CC(=N2)C3CC3)C(=O)NC4=C(C=C(C=C4)Br)C

Isomeric SMILES

CCCCN1C2=C(C(=N1)C)C(=CC(=N2)C3CC3)C(=O)NC4=C(C=C(C=C4)Br)C

InChI

InChI=1S/C22H25BrN4O/c1-4-5-10-27-21-20(14(3)26-27)17(12-19(24-21)15-6-7-15)22(28)25-18-9-8-16(23)11-13(18)2/h8-9,11-12,15H,4-7,10H2,1-3H3,(H,25,28)