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

Systemtic Name: 4-[[9-ethyl-2-[(4-oxidanylcyclohexyl)amino]purin-6-yl]amino]-N-methyl-N-(2-methylpropyl)benzenesulfonamide Openeye Name: 4-[[9-ethyl-2-[(4-hydroxycyclohexyl)amino]purin-6-yl]amino]-N-isobutyl-N-methyl-benzenesulfonamide CAS Name: 4-[[9-ethyl-2-[(4-hydroxycyclohexyl)amino]-6-purinyl]amino]-N-methyl-N-(2-methylpropyl)benzenesulfonamide IUPAC Name: 4-[[9-ethyl-2-[(4-hydroxycyclohexyl)amino]purin-6-yl]amino]-N-methyl-N-(2-methylpropyl)benzenesulfonamide Traditional Name: 4-[[9-ethyl-2-[(4-hydroxycyclohexyl)amino]purin-6-yl]amino]-N-isobutyl-N-methyl-benzenesulfonamide Formula: C24H35N7O3S MolecularWeight: 501.6448

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=C(N=C2NC3=CC=C(C=C3)S(=O)(=O)N(C)CC(C)C)NC4CCC(CC4)O

Isomeric SMILES

CCN1C=NC2=C1N=C(N=C2NC3=CC=C(C=C3)S(=O)(=O)N(C)CC(C)C)NC4CCC(CC4)O

InChI

InChI=1S/C24H35N7O3S/c1-5-31-15-25-21-22(28-24(29-23(21)31)27-18-6-10-19(32)11-7-18)26-17-8-12-20(13-9-17)35(33,34)30(4)14-16(2)3/h8-9,12-13,15-16,18-19,32H,5-7,10-11,14H2,1-4H3,(H2,26,27,28,29)