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

Systemtic Name: N-cyclohexyl-9-[3-(dimethylamino)propyl]-2-methyl-8-phenyl-purin-6-amine Openeye Name: N-cyclohexyl-9-[3-(dimethylamino)propyl]-2-methyl-8-phenyl-purin-6-amine CAS Name: N-cyclohexyl-9-[3-(dimethylamino)propyl]-2-methyl-8-phenyl-6-purinamine IUPAC Name: N-cyclohexyl-9-[3-(dimethylamino)propyl]-2-methyl-8-phenylpurin-6-amine Traditional Name: 3-[6-(cyclohexylamino)-2-methyl-8-phenyl-purin-9-yl]propyl-dimethyl-amine Formula: C23H32N6 MolecularWeight: 392.54038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)NC3CCCCC3)N=C(N2CCCN(C)C)C4=CC=CC=C4

Isomeric SMILES

CC1=NC2=C(C(=N1)NC3CCCCC3)N=C(N2CCCN(C)C)C4=CC=CC=C4

InChI

InChI=1S/C23H32N6/c1-17-24-21(26-19-13-8-5-9-14-19)20-23(25-17)29(16-10-15-28(2)3)22(27-20)18-11-6-4-7-12-18/h4,6-7,11-12,19H,5,8-10,13-16H2,1-3H3,(H,24,25,26)