1-ethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: 1-ethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: 1-ethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: 1-ethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-6-thiophen-2-yl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1-ethyl-N-(6-methylsulfonyl-1,3-benzothiazol-2-yl)-6-thiophen-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: 1-ethyl-N-(6-mesyl-1,3-benzothiazol-2-yl)-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C21H17N5O3S3 MolecularWeight: 483.58638

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)NC4=NC5=C(S4)C=C(C=C5)S(=O)(=O)C

Isomeric SMILES

CCN1C2=C(C=N1)C(=CC(=N2)C3=CC=CS3)C(=O)NC4=NC5=C(S4)C=C(C=C5)S(=O)(=O)C

InChI

InChI=1S/C21H17N5O3S3/c1-3-26-19-14(11-22-26)13(10-16(23-19)17-5-4-8-30-17)20(27)25-21-24-15-7-6-12(32(2,28)29)9-18(15)31-21/h4-11H,3H2,1-2H3,(H,24,25,27)