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

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-3,6-dimethyl-1-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-3,6-dimethyl-1-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-(3-chloro-4-fluorophenyl)-3,6-dimethyl-1-phenyl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-3,6-dimethyl-1-phenylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-3,6-dimethyl-1-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C21H16ClFN4O MolecularWeight: 394.829343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2C3=CC=CC=C3)C)C(=C1)C(=O)NC4=CC(=C(C=C4)F)Cl

Isomeric SMILES

CC1=NC2=C(C(=NN2C3=CC=CC=C3)C)C(=C1)C(=O)NC4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C21H16ClFN4O/c1-12-10-16(21(28)25-14-8-9-18(23)17(22)11-14)19-13(2)26-27(20(19)24-12)15-6-4-3-5-7-15/h3-11H,1-2H3,(H,25,28)