4-[2-[[9-[5-(diethylamino)pentan-2-yl]purin-6-yl]amino]ethyl]benzenesulfonamide

Systemtic Name: 4-[2-[[9-[5-(diethylamino)pentan-2-yl]purin-6-yl]amino]ethyl]benzenesulfonamide Openeye Name: 4-[2-[[9-[4-(diethylamino)-1-methyl-butyl]purin-6-yl]amino]ethyl]benzenesulfonamide CAS Name: 4-[2-[[9-[5-(diethylamino)pentan-2-yl]-6-purinyl]amino]ethyl]benzenesulfonamide IUPAC Name: 4-[2-[[9-[5-(diethylamino)pentan-2-yl]purin-6-yl]amino]ethyl]benzenesulfonamide Traditional Name: 4-[2-[[9-[4-(diethylamino)-1-methyl-butyl]purin-6-yl]amino]ethyl]benzenesulfonamide Formula: C22H33N7O2S MolecularWeight: 459.60812

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCC(C)N1C=NC2=C1N=CN=C2NCCC3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CCN(CC)CCCC(C)N1C=NC2=C1N=CN=C2NCCC3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C22H33N7O2S/c1-4-28(5-2)14-6-7-17(3)29-16-27-20-21(25-15-26-22(20)29)24-13-12-18-8-10-19(11-9-18)32(23,30)31/h8-11,15-17H,4-7,12-14H2,1-3H3,(H2,23,30,31)(H,24,25,26)