1-ethyl-4-(oxan-4-ylamino)-N-[1-(4-sulfamoylphenyl)ethyl]pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: 1-ethyl-4-(oxan-4-ylamino)-N-[1-(4-sulfamoylphenyl)ethyl]pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 1-ethyl-N-[1-(4-sulfamoylphenyl)ethyl]-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: 1-ethyl-4-(4-oxanylamino)-N-[1-(4-sulfamoylphenyl)ethyl]-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1-ethyl-4-(oxan-4-ylamino)-N-[1-(4-sulfamoylphenyl)ethyl]pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 1-ethyl-N-[1-(4-sulfamoylphenyl)ethyl]-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C22H28N6O4S MolecularWeight: 472.56052

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC=C(C(=C2C=N1)NC3CCOCC3)C(=O)NC(C)C4=CC=C(C=C4)S(=O)(=O)N

Isomeric SMILES

CCN1C2=NC=C(C(=C2C=N1)NC3CCOCC3)C(=O)NC(C)C4=CC=C(C=C4)S(=O)(=O)N

InChI

InChI=1S/C22H28N6O4S/c1-3-28-21-18(13-25-28)20(27-16-8-10-32-11-9-16)19(12-24-21)22(29)26-14(2)15-4-6-17(7-5-15)33(23,30)31/h4-7,12-14,16H,3,8-11H2,1-2H3,(H,24,27)(H,26,29)(H2,23,30,31)