N-[2-(5-bromanylthiophen-2-yl)ethyl]-1,3,6-trimethyl-pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: N-[2-(5-bromanylthiophen-2-yl)ethyl]-1,3,6-trimethyl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-[2-(5-bromo-2-thienyl)ethyl]-1,3,6-trimethyl-pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-[2-(5-bromo-2-thiophenyl)ethyl]-1,3,6-trimethyl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-[2-(5-bromothiophen-2-yl)ethyl]-1,3,6-trimethylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-[2-(5-bromo-2-thienyl)ethyl]-1,3,6-trimethyl-pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C16H17BrN4OS MolecularWeight: 393.30138

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=NN2C)C)C(=C1)C(=O)NCCC3=CC=C(S3)Br

Isomeric SMILES

CC1=NC2=C(C(=NN2C)C)C(=C1)C(=O)NCCC3=CC=C(S3)Br

InChI

InChI=1S/C16H17BrN4OS/c1-9-8-12(14-10(2)20-21(3)15(14)19-9)16(22)18-7-6-11-4-5-13(17)23-11/h4-5,8H,6-7H2,1-3H3,(H,18,22)