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

Systemtic Name: N-[[1,6-diethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-1-phenyl-methanesulfonamide Openeye Name: N-[[1,6-diethyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-1-phenyl-methanesulfonamide CAS Name: N-[[1,6-diethyl-4-(4-oxanylamino)-5-pyrazolo[3,4-b]pyridinyl]methyl]-1-phenylmethanesulfonamide IUPAC Name: N-[[1,6-diethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-1-phenylmethanesulfonamide Traditional Name: N-[[1,6-diethyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-1-phenyl-methanesulfonamide Formula: C23H31N5O3S MolecularWeight: 457.58894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C=NN(C2=N1)CC)NC3CCOCC3)CNS(=O)(=O)CC4=CC=CC=C4

Isomeric SMILES

CCC1=C(C(=C2C=NN(C2=N1)CC)NC3CCOCC3)CNS(=O)(=O)CC4=CC=CC=C4

InChI

InChI=1S/C23H31N5O3S/c1-3-21-19(15-25-32(29,30)16-17-8-6-5-7-9-17)22(26-18-10-12-31-13-11-18)20-14-24-28(4-2)23(20)27-21/h5-9,14,18,25H,3-4,10-13,15-16H2,1-2H3,(H,26,27)