9-pentyl-8-pyrazol-1-yl-purine-2,6-diamine

Systemtic Name: 9-pentyl-8-pyrazol-1-yl-purine-2,6-diamine Openeye Name: 9-pentyl-8-pyrazol-1-yl-purine-2,6-diamine CAS Name: 9-pentyl-8-(1-pyrazolyl)purine-2,6-diamine IUPAC Name: 9-pentyl-8-pyrazol-1-ylpurine-2,6-diamine Traditional Name: (2-amino-9-amyl-8-pyrazol-1-yl-purin-6-yl)amine Formula: C13H18N8 MolecularWeight: 286.33562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C2=C(C(=NC(=N2)N)N)N=C1N3C=CC=N3

Isomeric SMILES

CCCCCN1C2=C(C(=NC(=N2)N)N)N=C1N3C=CC=N3

InChI

InChI=1S/C13H18N8/c1-2-3-4-7-20-11-9(10(14)18-12(15)19-11)17-13(20)21-8-5-6-16-21/h5-6,8H,2-4,7H2,1H3,(H4,14,15,18,19)