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

Systemtic Name: 2-[[9-ethyl-2-[(4-oxidanylcyclohexyl)amino]purin-6-yl]amino]-4-phenoxy-N-phenyl-benzenesulfonamide Openeye Name: 2-[[9-ethyl-2-[(4-hydroxycyclohexyl)amino]purin-6-yl]amino]-4-phenoxy-N-phenyl-benzenesulfonamide CAS Name: 2-[[9-ethyl-2-[(4-hydroxycyclohexyl)amino]-6-purinyl]amino]-4-phenoxy-N-phenylbenzenesulfonamide IUPAC Name: 2-[[9-ethyl-2-[(4-hydroxycyclohexyl)amino]purin-6-yl]amino]-4-phenoxy-N-phenylbenzenesulfonamide Traditional Name: 2-[[9-ethyl-2-[(4-hydroxycyclohexyl)amino]purin-6-yl]amino]-4-phenoxy-N-phenyl-benzenesulfonamide Formula: C31H33N7O4S MolecularWeight: 599.70322

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=C(N=C2NC3=C(C=CC(=C3)OC4=CC=CC=C4)S(=O)(=O)NC5=CC=CC=C5)NC6CCC(CC6)O

Isomeric SMILES

CCN1C=NC2=C1N=C(N=C2NC3=C(C=CC(=C3)OC4=CC=CC=C4)S(=O)(=O)NC5=CC=CC=C5)NC6CCC(CC6)O

InChI

InChI=1S/C31H33N7O4S/c1-2-38-20-32-28-29(35-31(36-30(28)38)33-21-13-15-23(39)16-14-21)34-26-19-25(42-24-11-7-4-8-12-24)17-18-27(26)43(40,41)37-22-9-5-3-6-10-22/h3-12,17-21,23,37,39H,2,13-16H2,1H3,(H2,33,34,35,36)