1-[[9-ethyl-2-[(4-oxidanylcyclohexyl)amino]purin-6-yl]amino]-2-methyl-N-phenyl-propane-1-sulfonamide

Systemtic Name: 1-[[9-ethyl-2-[(4-oxidanylcyclohexyl)amino]purin-6-yl]amino]-2-methyl-N-phenyl-propane-1-sulfonamide Openeye Name: 1-[[9-ethyl-2-[(4-hydroxycyclohexyl)amino]purin-6-yl]amino]-2-methyl-N-phenyl-propane-1-sulfonamide CAS Name: 1-[[9-ethyl-2-[(4-hydroxycyclohexyl)amino]-6-purinyl]amino]-2-methyl-N-phenyl-1-propanesulfonamide IUPAC Name: 1-[[9-ethyl-2-[(4-hydroxycyclohexyl)amino]purin-6-yl]amino]-2-methyl-N-phenylpropane-1-sulfonamide Traditional Name: 1-[[9-ethyl-2-[(4-hydroxycyclohexyl)amino]purin-6-yl]amino]-2-methyl-N-phenyl-propane-1-sulfonamide Formula: C23H33N7O3S MolecularWeight: 487.61822

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=NC2=C1N=C(N=C2NC(C(C)C)S(=O)(=O)NC3=CC=CC=C3)NC4CCC(CC4)O

Isomeric SMILES

CCN1C=NC2=C1N=C(N=C2NC(C(C)C)S(=O)(=O)NC3=CC=CC=C3)NC4CCC(CC4)O

InChI

InChI=1S/C23H33N7O3S/c1-4-30-14-24-19-20(27-23(28-21(19)30)25-16-10-12-18(31)13-11-16)26-22(15(2)3)34(32,33)29-17-8-6-5-7-9-17/h5-9,14-16,18,22,29,31H,4,10-13H2,1-3H3,(H2,25,26,27,28)