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

Systemtic Name: ethane; N-[4-[[9-ethyl-2-[(4-oxidanylcyclohexyl)amino]purin-6-yl]amino]pyridin-2-yl]benzenesulfonamide Openeye Name: ethane; N-[4-[[9-ethyl-2-[(4-hydroxycyclohexyl)amino]purin-6-yl]amino]-2-pyridyl]benzenesulfonamide CAS Name: ethane; N-[4-[[9-ethyl-2-[(4-hydroxycyclohexyl)amino]-6-purinyl]amino]-2-pyridinyl]benzenesulfonamide IUPAC Name: ethane; N-[4-[[9-ethyl-2-[(4-hydroxycyclohexyl)amino]purin-6-yl]amino]pyridin-2-yl]benzenesulfonamide Traditional Name: ethane; N-[4-[[9-ethyl-2-[(4-hydroxycyclohexyl)amino]purin-6-yl]amino]-2-pyridyl]benzenesulfonamide Formula: C26H34N8O3S MolecularWeight: 538.66496

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Descriptors Computed from Structure

Canonical SMILES:

CC.CCN1C=NC2=C1N=C(N=C2NC3=CC(=NC=C3)NS(=O)(=O)C4=CC=CC=C4)NC5CCC(CC5)O

Isomeric SMILES

CC.CCN1C=NC2=C1N=C(N=C2NC3=CC(=NC=C3)NS(=O)(=O)C4=CC=CC=C4)NC5CCC(CC5)O

InChI

InChI=1S/C24H28N8O3S.C2H6/c1-2-32-15-26-21-22(29-24(30-23(21)32)28-16-8-10-18(33)11-9-16)27-17-12-13-25-20(14-17)31-36(34,35)19-6-4-3-5-7-19;1-2/h3-7,12-16,18,33H,2,8-11H2,1H3,(H3,25,27,28,29,30,31);1-2H3