N-[[1,6-diethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]propane-2-sulfonamide

Systemtic Name: N-[[1,6-diethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]propane-2-sulfonamide Openeye Name: N-[[1,6-diethyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]propane-2-sulfonamide CAS Name: N-[[1,6-diethyl-4-(4-oxanylamino)-5-pyrazolo[3,4-b]pyridinyl]methyl]-2-propanesulfonamide IUPAC Name: N-[[1,6-diethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]propane-2-sulfonamide Traditional Name: N-[[1,6-diethyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]propane-2-sulfonamide Formula: C19H31N5O3S MolecularWeight: 409.54614

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C=NN(C2=N1)CC)NC3CCOCC3)CNS(=O)(=O)C(C)C

Isomeric SMILES

CCC1=C(C(=C2C=NN(C2=N1)CC)NC3CCOCC3)CNS(=O)(=O)C(C)C

InChI

InChI=1S/C19H31N5O3S/c1-5-17-15(12-21-28(25,26)13(3)4)18(22-14-7-9-27-10-8-14)16-11-20-24(6-2)19(16)23-17/h11,13-14,21H,5-10,12H2,1-4H3,(H,22,23)