6-methyl-1-(thiophen-2-ylmethyl)-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: 6-methyl-1-(thiophen-2-ylmethyl)-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: 6-methyl-1-(2-thienylmethyl)-N-[2-(2-thienylmethylsulfanyl)ethyl]pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: 6-methyl-1-(thiophen-2-ylmethyl)-N-[2-(thiophen-2-ylmethylthio)ethyl]-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 6-methyl-1-(thiophen-2-ylmethyl)-N-[2-(thiophen-2-ylmethylsulfanyl)ethyl]pyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: 6-methyl-1-(2-thenyl)-N-[2-(2-thenylthio)ethyl]pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C20H20N4OS3 MolecularWeight: 428.594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=NN2CC3=CC=CS3)C(=C1)C(=O)NCCSCC4=CC=CS4

Isomeric SMILES

CC1=NC2=C(C=NN2CC3=CC=CS3)C(=C1)C(=O)NCCSCC4=CC=CS4

InChI

InChI=1S/C20H20N4OS3/c1-14-10-17(20(25)21-6-9-26-13-16-5-3-8-28-16)18-11-22-24(19(18)23-14)12-15-4-2-7-27-15/h2-5,7-8,10-11H,6,9,12-13H2,1H3,(H,21,25)