1-butyl-3,6-dimethyl-N-phenyl-N-(phenylmethyl)pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: 1-butyl-3,6-dimethyl-N-phenyl-N-(phenylmethyl)pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-benzyl-1-butyl-3,6-dimethyl-N-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: 1-butyl-3,6-dimethyl-N-phenyl-N-(phenylmethyl)-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-benzyl-1-butyl-3,6-dimethyl-N-phenylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-benzyl-1-butyl-3,6-dimethyl-N-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C26H28N4O MolecularWeight: 412.52672

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C(=N1)C)C(=CC(=N2)C)C(=O)N(CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCCN1C2=C(C(=N1)C)C(=CC(=N2)C)C(=O)N(CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H28N4O/c1-4-5-16-30-25-24(20(3)28-30)23(17-19(2)27-25)26(31)29(22-14-10-7-11-15-22)18-21-12-8-6-9-13-21/h6-15,17H,4-5,16,18H2,1-3H3