9-(2-methylpropyl)-8-pyrazol-1-yl-N2-pyridin-4-yl-purine-2,6-diamine

Systemtic Name: 9-(2-methylpropyl)-8-pyrazol-1-yl-N2-pyridin-4-yl-purine-2,6-diamine Openeye Name: 9-isobutyl-8-pyrazol-1-yl-N2-(4-pyridyl)purine-2,6-diamine CAS Name: 9-(2-methylpropyl)-8-(1-pyrazolyl)-N2-pyridin-4-ylpurine-2,6-diamine IUPAC Name: 9-(2-methylpropyl)-8-pyrazol-1-yl-2-N-pyridin-4-ylpurine-2,6-diamine Traditional Name: (6-amino-9-isobutyl-8-pyrazol-1-yl-purin-2-yl)-(4-pyridyl)amine Formula: C17H19N9 MolecularWeight: 349.39306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C2=C(C(=NC(=N2)NC3=CC=NC=C3)N)N=C1N4C=CC=N4

Isomeric SMILES

CC(C)CN1C2=C(C(=NC(=N2)NC3=CC=NC=C3)N)N=C1N4C=CC=N4

InChI

InChI=1S/C17H19N9/c1-11(2)10-25-15-13(22-17(25)26-9-3-6-20-26)14(18)23-16(24-15)21-12-4-7-19-8-5-12/h3-9,11H,10H2,1-2H3,(H3,18,19,21,23,24)