actinium; [4-[[6-[2-(4-phenylphenoxy)ethylamino]-9-propan-2-yl-purin-2-yl]amino]cyclohexyl]azanide

Systemtic Name: actinium; [4-[[6-[2-(4-phenylphenoxy)ethylamino]-9-propan-2-yl-purin-2-yl]amino]cyclohexyl]azanide Openeye Name: actinium; [4-[[9-isopropyl-6-[2-(4-phenylphenoxy)ethylamino]purin-2-yl]amino]cyclohexyl]azanide CAS Name: actinium; [4-[[6-[2-(4-phenylphenoxy)ethylamino]-9-propan-2-yl-2-purinyl]amino]cyclohexyl]azanide IUPAC Name: actinium; [4-[[6-[2-(4-phenylphenoxy)ethylamino]-9-propan-2-ylpurin-2-yl]amino]cyclohexyl]azanide Traditional Name: actinium; [4-[[9-isopropyl-6-[2-(4-phenylphenoxy)ethylamino]purin-2-yl]amino]cyclohexyl]azanide Formula: C28H34AcN7O- MolecularWeight: 711.643607

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCCOC3=CC=C(C=C3)C4=CC=CC=C4)NC5CCC(CC5)[NH-].[Ac]

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCCOC3=CC=C(C=C3)C4=CC=CC=C4)NC5CCC(CC5)[NH-].[Ac]

InChI

InChI=1S/C28H34N7O.Ac/c1-19(2)35-18-31-25-26(33-28(34-27(25)35)32-23-12-10-22(29)11-13-23)30-16-17-36-24-14-8-21(9-15-24)20-6-4-3-5-7-20;/h3-9,14-15,18-19,22-23,29H,10-13,16-17H2,1-2H3,(H2,30,32,33,34);/q-1;