9-(2-methylpropyl)-8-pyrimidin-2-yl-purine-2,6-diamine

Systemtic Name: 9-(2-methylpropyl)-8-pyrimidin-2-yl-purine-2,6-diamine Openeye Name: 9-isobutyl-8-pyrimidin-2-yl-purine-2,6-diamine CAS Name: 9-(2-methylpropyl)-8-(2-pyrimidinyl)purine-2,6-diamine IUPAC Name: 9-(2-methylpropyl)-8-pyrimidin-2-ylpurine-2,6-diamine Traditional Name: [2-amino-9-isobutyl-8-(2-pyrimidyl)purin-6-yl]amine Formula: C13H16N8 MolecularWeight: 284.31974

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C(=NC(=N2)N)N)N=C1C3=NC=CC=N3

Isomeric SMILES

CC(C)CN1C2=C(C(=NC(=N2)N)N)N=C1C3=NC=CC=N3

InChI

InChI=1S/C13H16N8/c1-7(2)6-21-11-8(9(14)19-13(15)20-11)18-12(21)10-16-4-3-5-17-10/h3-5,7H,6H2,1-2H3,(H4,14,15,19,20)