8-bromanyl-N2-butyl-9-(2-methylpropyl)purine-2,6-diamine

Systemtic Name: 8-bromanyl-N2-butyl-9-(2-methylpropyl)purine-2,6-diamine Openeye Name: 8-bromo-N2-butyl-9-isobutyl-purine-2,6-diamine CAS Name: 8-bromo-N2-butyl-9-(2-methylpropyl)purine-2,6-diamine IUPAC Name: 8-bromo-2-N-butyl-9-(2-methylpropyl)purine-2,6-diamine Traditional Name: (6-amino-8-bromo-9-isobutyl-purin-2-yl)-butyl-amine Formula: C13H21BrN6 MolecularWeight: 341.25004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC2=C(C(=N1)N)N=C(N2CC(C)C)Br

Isomeric SMILES

CCCCNC1=NC2=C(C(=N1)N)N=C(N2CC(C)C)Br

InChI

InChI=1S/C13H21BrN6/c1-4-5-6-16-13-18-10(15)9-11(19-13)20(7-8(2)3)12(14)17-9/h8H,4-7H2,1-3H3,(H3,15,16,18,19)