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

Systemtic Name: 4-[[9-ethyl-2-[(4-oxidanylcyclohexyl)amino]purin-6-yl]amino]-N-propan-2-yl-benzenesulfonamide Openeye Name: 4-[[9-ethyl-2-[(4-hydroxycyclohexyl)amino]purin-6-yl]amino]-N-isopropyl-benzenesulfonamide CAS Name: 4-[[9-ethyl-2-[(4-hydroxycyclohexyl)amino]-6-purinyl]amino]-N-propan-2-ylbenzenesulfonamide IUPAC Name: 4-[[9-ethyl-2-[(4-hydroxycyclohexyl)amino]purin-6-yl]amino]-N-propan-2-ylbenzenesulfonamide Traditional Name: 4-[[9-ethyl-2-[(4-hydroxycyclohexyl)amino]purin-6-yl]amino]-N-isopropyl-benzenesulfonamide Formula: C22H31N7O3S MolecularWeight: 473.59164

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H31N7O3S/c1-4-29-13-23-19-20(24-15-7-11-18(12-8-15)33(31,32)28-14(2)3)26-22(27-21(19)29)25-16-5-9-17(30)10-6-16/h7-8,11-14,16-17,28,30H,4-6,9-10H2,1-3H3,(H2,24,25,26,27)