N-[[1,6-diethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[[1,6-diethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[[1,6-diethyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-[[1,6-diethyl-4-(4-oxanylamino)-5-pyrazolo[3,4-b]pyridinyl]methyl]-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[[1,6-diethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: N-[[1,6-diethyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-1-mesyl-isonipecotamide Formula: C23H36N6O4S MolecularWeight: 492.63474

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C=NN(C2=N1)CC)NC3CCOCC3)CNC(=O)C4CCN(CC4)S(=O)(=O)C

Isomeric SMILES

CCC1=C(C(=C2C=NN(C2=N1)CC)NC3CCOCC3)CNC(=O)C4CCN(CC4)S(=O)(=O)C

InChI

InChI=1S/C23H36N6O4S/c1-4-20-18(14-24-23(30)16-6-10-28(11-7-16)34(3,31)32)21(26-17-8-12-33-13-9-17)19-15-25-29(5-2)22(19)27-20/h15-17H,4-14H2,1-3H3,(H,24,30)(H,26,27)