N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-1-ethyl-N-methyl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: N-[(2-chloranyl-6-fluoranyl-phenyl)methyl]-1-ethyl-N-methyl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-[(2-chloro-6-fluoro-phenyl)methyl]-1-ethyl-N-methyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-[(2-chloro-6-fluorophenyl)methyl]-1-ethyl-N-methyl-6-thiophen-2-yl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-[(2-chloro-6-fluorophenyl)methyl]-1-ethyl-N-methyl-6-thiophen-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-(2-chloro-6-fluoro-benzyl)-1-ethyl-N-methyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C21H18ClFN4OS MolecularWeight: 428.910223

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)N(C)CC4=C(C=CC=C4Cl)F

Isomeric SMILES

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)N(C)CC4=C(C=CC=C4Cl)F

InChI

InChI=1S/C21H18ClFN4OS/c1-3-27-20-14(11-24-27)13(10-18(25-20)19-8-5-9-29-19)21(28)26(2)12-15-16(22)6-4-7-17(15)23/h4-11H,3,12H2,1-2H3