8-bromanyl-N2-methyl-N2-phenyl-9-(phenylmethyl)purine-2,6-diamine

Systemtic Name: 8-bromanyl-N2-methyl-N2-phenyl-9-(phenylmethyl)purine-2,6-diamine Openeye Name: 9-benzyl-8-bromo-N2-methyl-N2-phenyl-purine-2,6-diamine CAS Name: 8-bromo-N2-methyl-N2-phenyl-9-(phenylmethyl)purine-2,6-diamine IUPAC Name: 9-benzyl-8-bromo-2-N-methyl-2-N-phenylpurine-2,6-diamine Traditional Name: (6-amino-9-benzyl-8-bromo-purin-2-yl)-methyl-phenyl-amine Formula: C19H17BrN6 MolecularWeight: 409.28248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C1=CC=CC=C1)C2=NC3=C(C(=N2)N)N=C(N3CC4=CC=CC=C4)Br

Isomeric SMILES

CN(C1=CC=CC=C1)C2=NC3=C(C(=N2)N)N=C(N3CC4=CC=CC=C4)Br

InChI

InChI=1S/C19H17BrN6/c1-25(14-10-6-3-7-11-14)19-23-16(21)15-17(24-19)26(18(20)22-15)12-13-8-4-2-5-9-13/h2-11H,12H2,1H3,(H2,21,23,24)