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

Systemtic Name: actinium; [4-[[6-[2-(4-phenylphenyl)ethylamino]-9-propan-2-yl-purin-2-yl]amino]cyclohexyl]azanide Openeye Name: actinium; [4-[[9-isopropyl-6-[2-(4-phenylphenyl)ethylamino]purin-2-yl]amino]cyclohexyl]azanide CAS Name: actinium; [4-[[6-[2-(4-phenylphenyl)ethylamino]-9-propan-2-yl-2-purinyl]amino]cyclohexyl]azanide IUPAC Name: actinium; [4-[[6-[2-(4-phenylphenyl)ethylamino]-9-propan-2-ylpurin-2-yl]amino]cyclohexyl]azanide Traditional Name: actinium; [4-[[9-isopropyl-6-[2-(4-phenylphenyl)ethylamino]purin-2-yl]amino]cyclohexyl]azanide Formula: C28H34AcN7- MolecularWeight: 695.644207

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C=NC2=C1N=C(N=C2NCCC3=CC=C(C=C3)C4=CC=CC=C4)NC5CCC(CC5)[NH-].[Ac]

Isomeric SMILES

CC(C)N1C=NC2=C1N=C(N=C2NCCC3=CC=C(C=C3)C4=CC=CC=C4)NC5CCC(CC5)[NH-].[Ac]

InChI

InChI=1S/C28H34N7.Ac/c1-19(2)35-18-31-25-26(33-28(34-27(25)35)32-24-14-12-23(29)13-15-24)30-17-16-20-8-10-22(11-9-20)21-6-4-3-5-7-21;/h3-11,18-19,23-24,29H,12-17H2,1-2H3,(H2,30,32,33,34);/q-1;