N-[(2-piperidin-1-ylsulfonylphenyl)methyl]-1-propan-2-yl-pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: N-[(2-piperidin-1-ylsulfonylphenyl)methyl]-1-propan-2-yl-pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 1-isopropyl-N-[[2-(1-piperidylsulfonyl)phenyl]methyl]pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: N-[[2-(1-piperidinylsulfonyl)phenyl]methyl]-1-propan-2-yl-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-[(2-piperidin-1-ylsulfonylphenyl)methyl]-1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 1-isopropyl-N-(2-piperidinosulfonylbenzyl)pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C22H27N5O3S MolecularWeight: 441.54648

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=NC=C(C=C2C=N1)C(=O)NCC3=CC=CC=C3S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC(C)N1C2=NC=C(C=C2C=N1)C(=O)NCC3=CC=CC=C3S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C22H27N5O3S/c1-16(2)27-21-18(15-25-27)12-19(14-23-21)22(28)24-13-17-8-4-5-9-20(17)31(29,30)26-10-6-3-7-11-26/h4-5,8-9,12,14-16H,3,6-7,10-11,13H2,1-2H3,(H,24,28)