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

Systemtic Name: 9-[3-(dimethylamino)-2,2-dimethyl-propyl]-2-methyl-8-phenyl-N-(phenylmethyl)purin-6-amine Openeye Name: N-benzyl-9-[3-(dimethylamino)-2,2-dimethyl-propyl]-2-methyl-8-phenyl-purin-6-amine CAS Name: 9-[3-(dimethylamino)-2,2-dimethylpropyl]-2-methyl-8-phenyl-N-(phenylmethyl)-6-purinamine IUPAC Name: N-benzyl-9-[3-(dimethylamino)-2,2-dimethylpropyl]-2-methyl-8-phenylpurin-6-amine Traditional Name: [3-[6-(benzylamino)-2-methyl-8-phenyl-purin-9-yl]-2,2-dimethyl-propyl]-dimethyl-amine Formula: C26H32N6 MolecularWeight: 428.57248

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(=N1)NCC3=CC=CC=C3)N=C(N2CC(C)(C)CN(C)C)C4=CC=CC=C4

Isomeric SMILES

CC1=NC2=C(C(=N1)NCC3=CC=CC=C3)N=C(N2CC(C)(C)CN(C)C)C4=CC=CC=C4

InChI

InChI=1S/C26H32N6/c1-19-28-23(27-16-20-12-8-6-9-13-20)22-25(29-19)32(18-26(2,3)17-31(4)5)24(30-22)21-14-10-7-11-15-21/h6-15H,16-18H2,1-5H3,(H,27,28,29)