N-cyclohexyl-4-[[9-ethyl-2-[(4-oxidanylcyclohexyl)amino]purin-6-yl]amino]benzenesulfonamide

Systemtic Name: N-cyclohexyl-4-[[9-ethyl-2-[(4-oxidanylcyclohexyl)amino]purin-6-yl]amino]benzenesulfonamide Openeye Name: N-cyclohexyl-4-[[9-ethyl-2-[(4-hydroxycyclohexyl)amino]purin-6-yl]amino]benzenesulfonamide CAS Name: N-cyclohexyl-4-[[9-ethyl-2-[(4-hydroxycyclohexyl)amino]-6-purinyl]amino]benzenesulfonamide IUPAC Name: N-cyclohexyl-4-[[9-ethyl-2-[(4-hydroxycyclohexyl)amino]purin-6-yl]amino]benzenesulfonamide Traditional Name: N-cyclohexyl-4-[[9-ethyl-2-[(4-hydroxycyclohexyl)amino]purin-6-yl]amino]benzenesulfonamide Formula: C25H35N7O3S MolecularWeight: 513.6555

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=C(N=C2NC3=CC=C(C=C3)S(=O)(=O)NC4CCCCC4)NC5CCC(CC5)O

Isomeric SMILES

CCN1C=NC2=C1N=C(N=C2NC3=CC=C(C=C3)S(=O)(=O)NC4CCCCC4)NC5CCC(CC5)O

InChI

InChI=1S/C25H35N7O3S/c1-2-32-16-26-22-23(29-25(30-24(22)32)28-18-8-12-20(33)13-9-18)27-17-10-14-21(15-11-17)36(34,35)31-19-6-4-3-5-7-19/h10-11,14-16,18-20,31,33H,2-9,12-13H2,1H3,(H2,27,28,29,30)