1,3-dimethyl-N-(2-methyl-5-methylsulfonyl-phenyl)-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: 1,3-dimethyl-N-(2-methyl-5-methylsulfonyl-phenyl)-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: 1,3-dimethyl-N-(2-methyl-5-methylsulfonyl-phenyl)-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: 1,3-dimethyl-N-(2-methyl-5-methylsulfonylphenyl)-6-thiophen-2-yl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1,3-dimethyl-N-(2-methyl-5-methylsulfonylphenyl)-6-thiophen-2-ylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-(5-mesyl-2-methyl-phenyl)-1,3-dimethyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C21H20N4O3S2 MolecularWeight: 440.5385

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)C)NC(=O)C2=CC(=NC3=C2C(=NN3C)C)C4=CC=CS4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)C)NC(=O)C2=CC(=NC3=C2C(=NN3C)C)C4=CC=CS4

InChI

InChI=1S/C21H20N4O3S2/c1-12-7-8-14(30(4,27)28)10-16(12)23-21(26)15-11-17(18-6-5-9-29-18)22-20-19(15)13(2)24-25(20)3/h5-11H,1-4H3,(H,23,26)