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

Systemtic Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-1-ethyl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-1-ethyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-1-ethyl-6-thiophen-2-yl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-1-ethyl-6-thiophen-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-[4-acetamido-2-(trifluoromethyl)phenyl]-1-ethyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C22H18F3N5O2S MolecularWeight: 473.47083

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)NC4=C(C=C(C=C4)NC(=O)C)C(F)(F)F

Isomeric SMILES

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)NC4=C(C=C(C=C4)NC(=O)C)C(F)(F)F

InChI

InChI=1S/C22H18F3N5O2S/c1-3-30-20-15(11-26-30)14(10-18(28-20)19-5-4-8-33-19)21(32)29-17-7-6-13(27-12(2)31)9-16(17)22(23,24)25/h4-11H,3H2,1-2H3,(H,27,31)(H,29,32)