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

Systemtic Name: N-(3-chloranyl-4-cyano-phenyl)-1,3-dimethyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-(3-chloro-4-cyano-phenyl)-1,3-dimethyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-(3-chloro-4-cyanophenyl)-1,3-dimethyl-6-phenyl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-(3-chloro-4-cyanophenyl)-1,3-dimethyl-6-phenylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-(3-chloro-4-cyano-phenyl)-1,3-dimethyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C22H16ClN5O MolecularWeight: 401.84834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)NC4=CC(=C(C=C4)C#N)Cl)C

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CC=C3)C(=O)NC4=CC(=C(C=C4)C#N)Cl)C

InChI

InChI=1S/C22H16ClN5O/c1-13-20-17(22(29)25-16-9-8-15(12-24)18(23)10-16)11-19(14-6-4-3-5-7-14)26-21(20)28(2)27-13/h3-11H,1-2H3,(H,25,29)