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

Systemtic Name: 8-pyrazol-1-yl-9-(1-pyridin-4-ylpropyl)purine-2,6-diamine Openeye Name: 8-pyrazol-1-yl-9-[1-(4-pyridyl)propyl]purine-2,6-diamine CAS Name: 8-(1-pyrazolyl)-9-(1-pyridin-4-ylpropyl)purine-2,6-diamine IUPAC Name: 8-pyrazol-1-yl-9-(1-pyridin-4-ylpropyl)purine-2,6-diamine Traditional Name: [2-amino-8-pyrazol-1-yl-9-[1-(4-pyridyl)propyl]purin-6-yl]amine Formula: C16H17N9 MolecularWeight: 335.36648

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=NC=C1)N2C3=C(C(=NC(=N3)N)N)N=C2N4C=CC=N4

Isomeric SMILES

CCC(C1=CC=NC=C1)N2C3=C(C(=NC(=N3)N)N)N=C2N4C=CC=N4

InChI

InChI=1S/C16H17N9/c1-2-11(10-4-7-19-8-5-10)25-14-12(13(17)22-15(18)23-14)21-16(25)24-9-3-6-20-24/h3-9,11H,2H2,1H3,(H4,17,18,22,23)