4-[(4-chlorophenyl)methylamino]-3-methyl-N-(3-methylbutyl)-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: 4-[(4-chlorophenyl)methylamino]-3-methyl-N-(3-methylbutyl)-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 4-[(4-chlorophenyl)methylamino]-N-isopentyl-3-methyl-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: 4-[(4-chlorophenyl)methylamino]-3-methyl-N-(3-methylbutyl)-1-phenyl-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 4-[(4-chlorophenyl)methylamino]-3-methyl-N-(3-methylbutyl)-1-phenylpyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 4-[(4-chlorobenzyl)amino]-N-isoamyl-3-methyl-1-phenyl-pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C26H28ClN5O MolecularWeight: 461.98642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=NC=C(C(=C12)NCC3=CC=C(C=C3)Cl)C(=O)NCCC(C)C)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C2=NC=C(C(=C12)NCC3=CC=C(C=C3)Cl)C(=O)NCCC(C)C)C4=CC=CC=C4

InChI

InChI=1S/C26H28ClN5O/c1-17(2)13-14-28-26(33)22-16-30-25-23(18(3)31-32(25)21-7-5-4-6-8-21)24(22)29-15-19-9-11-20(27)12-10-19/h4-12,16-17H,13-15H2,1-3H3,(H,28,33)(H,29,30)