N-cyclohexyl-9-[3-(dimethylamino)-2,2-dimethyl-propyl]-2-methyl-8-phenyl-purin-6-amine

Systemtic Name: N-cyclohexyl-9-[3-(dimethylamino)-2,2-dimethyl-propyl]-2-methyl-8-phenyl-purin-6-amine Openeye Name: N-cyclohexyl-9-[3-(dimethylamino)-2,2-dimethyl-propyl]-2-methyl-8-phenyl-purin-6-amine CAS Name: N-cyclohexyl-9-[3-(dimethylamino)-2,2-dimethylpropyl]-2-methyl-8-phenyl-6-purinamine IUPAC Name: N-cyclohexyl-9-[3-(dimethylamino)-2,2-dimethylpropyl]-2-methyl-8-phenylpurin-6-amine Traditional Name: [3-[6-(cyclohexylamino)-2-methyl-8-phenyl-purin-9-yl]-2,2-dimethyl-propyl]-dimethyl-amine Formula: C25H36N6 MolecularWeight: 420.59354

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)NC3CCCCC3)N=C(N2CC(C)(C)CN(C)C)C4=CC=CC=C4

Isomeric SMILES

CC1=NC2=C(C(=N1)NC3CCCCC3)N=C(N2CC(C)(C)CN(C)C)C4=CC=CC=C4

InChI

InChI=1S/C25H36N6/c1-18-26-22(28-20-14-10-7-11-15-20)21-24(27-18)31(17-25(2,3)16-30(4)5)23(29-21)19-12-8-6-9-13-19/h6,8-9,12-13,20H,7,10-11,14-17H2,1-5H3,(H,26,27,28)