4-propoxy-2-(7H-purin-8-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide

Systemtic Name: 4-propoxy-2-(7H-purin-8-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide Openeye Name: 4-propoxy-2-(7H-purin-8-yl)-N-(2,2,6,6-tetramethyl-4-piperidyl)benzenesulfonamide CAS Name: 4-propoxy-2-(7H-purin-8-yl)-N-(2,2,6,6-tetramethyl-4-piperidinyl)benzenesulfonamide IUPAC Name: 4-propoxy-2-(7H-purin-8-yl)-N-(2,2,6,6-tetramethylpiperidin-4-yl)benzenesulfonamide Traditional Name: 4-propoxy-2-(7H-purin-8-yl)-N-(2,2,6,6-tetramethyl-4-piperidyl)benzenesulfonamide Formula: C23H32N6O3S MolecularWeight: 472.60358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=C(C=C1)S(=O)(=O)NC2CC(NC(C2)(C)C)(C)C)C3=NC4=NC=NC=C4N3

Isomeric SMILES

CCCOC1=CC(=C(C=C1)S(=O)(=O)NC2CC(NC(C2)(C)C)(C)C)C3=NC4=NC=NC=C4N3

InChI

InChI=1S/C23H32N6O3S/c1-6-9-32-16-7-8-19(17(10-16)20-26-18-13-24-14-25-21(18)27-20)33(30,31)28-15-11-22(2,3)29-23(4,5)12-15/h7-8,10,13-15,28-29H,6,9,11-12H2,1-5H3,(H,24,25,26,27)