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

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

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CS3)C(=O)NC4=NC5=C(S4)C=C(C=C5)S(=O)(=O)C)C

Isomeric SMILES

CC1=NN(C2=C1C(=CC(=N2)C3=CC=CS3)C(=O)NC4=NC5=C(S4)C=C(C=C5)S(=O)(=O)C)C

InChI

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