N-(4-methylsulfonylphenyl)-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: N-(4-methylsulfonylphenyl)-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-(4-methylsulfonylphenyl)-6-phenyl-1-(4-pyridylmethyl)pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-(4-methylsulfonylphenyl)-6-phenyl-1-(pyridin-4-ylmethyl)-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-(4-methylsulfonylphenyl)-6-phenyl-1-(pyridin-4-ylmethyl)pyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-(4-mesylphenyl)-6-phenyl-1-(4-pyridylmethyl)pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C26H21N5O3S MolecularWeight: 483.54164

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=NC3=C2C=NN3CC4=CC=NC=C4)C5=CC=CC=C5

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=NC3=C2C=NN3CC4=CC=NC=C4)C5=CC=CC=C5

InChI

InChI=1S/C26H21N5O3S/c1-35(33,34)21-9-7-20(8-10-21)29-26(32)22-15-24(19-5-3-2-4-6-19)30-25-23(22)16-28-31(25)17-18-11-13-27-14-12-18/h2-16H,17H2,1H3,(H,29,32)