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

Systemtic Name: N-(4-bromophenyl)-1-butyl-6-cyclopropyl-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-(4-bromophenyl)-1-butyl-6-cyclopropyl-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-(4-bromophenyl)-1-butyl-6-cyclopropyl-3-methyl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-(4-bromophenyl)-1-butyl-6-cyclopropyl-3-methylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-(4-bromophenyl)-1-butyl-6-cyclopropyl-3-methyl-pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C21H23BrN4O MolecularWeight: 427.33752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23BrN4O/c1-3-4-11-26-20-19(13(2)25-26)17(12-18(24-20)14-5-6-14)21(27)23-16-9-7-15(22)8-10-16/h7-10,12,14H,3-6,11H2,1-2H3,(H,23,27)