N-[3-(azepan-1-ylsulfonyl)phenyl]-6-methyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-6-methyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-1-isopropyl-6-methyl-pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-6-methyl-1-propan-2-yl-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-6-methyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-1-isopropyl-6-methyl-pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C23H29N5O3S MolecularWeight: 455.57306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=NN(C2=N1)C(C)C)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CC1=C(C=C2C=NN(C2=N1)C(C)C)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C23H29N5O3S/c1-16(2)28-22-18(15-24-28)13-21(17(3)25-22)23(29)26-19-9-8-10-20(14-19)32(30,31)27-11-6-4-5-7-12-27/h8-10,13-16H,4-7,11-12H2,1-3H3,(H,26,29)