1-ethyl-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: 1-ethyl-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-1-ethyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: 1-ethyl-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]-6-thiophen-2-yl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-1-ethyl-6-thiophen-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-1-ethyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C22H18N6OS3 MolecularWeight: 478.61292

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)NC4=NN=C(S4)SCC5=CC=CC=C5

Isomeric SMILES

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)NC4=NN=C(S4)SCC5=CC=CC=C5

InChI

InChI=1S/C22H18N6OS3/c1-2-28-19-16(12-23-28)15(11-17(24-19)18-9-6-10-30-18)20(29)25-21-26-27-22(32-21)31-13-14-7-4-3-5-8-14/h3-12H,2,13H2,1H3,(H,25,26,29)