2-(4-chlorophenyl)-1-(3-methylbutyl)-4-phenyl-pyrazolo[3,4-b]pyridin-3-one

Systemtic Name: 2-(4-chlorophenyl)-1-(3-methylbutyl)-4-phenyl-pyrazolo[3,4-b]pyridin-3-one Openeye Name: 2-(4-chlorophenyl)-1-isopentyl-4-phenyl-pyrazolo[3,4-b]pyridin-3-one CAS Name: 2-(4-chlorophenyl)-1-(3-methylbutyl)-4-phenyl-3-pyrazolo[3,4-b]pyridinone IUPAC Name: 2-(4-chlorophenyl)-1-(3-methylbutyl)-4-phenylpyrazolo[3,4-b]pyridin-3-one Traditional Name: 2-(4-chlorophenyl)-1-isoamyl-4-phenyl-pyrazolo[3,4-b]pyridin-3-one Formula: C23H22ClN3O MolecularWeight: 391.89328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C2=NC=CC(=C2C(=O)N1C3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

CC(C)CCN1C2=NC=CC(=C2C(=O)N1C3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C23H22ClN3O/c1-16(2)13-15-26-22-21(20(12-14-25-22)17-6-4-3-5-7-17)23(28)27(26)19-10-8-18(24)9-11-19/h3-12,14,16H,13,15H2,1-2H3