9-[(E)-hept-4-enyl]-8-pyrazol-1-yl-purine-2,6-diamine

Systemtic Name: 9-[(E)-hept-4-enyl]-8-pyrazol-1-yl-purine-2,6-diamine Openeye Name: 9-[(E)-hept-4-enyl]-8-pyrazol-1-yl-purine-2,6-diamine CAS Name: 9-[(E)-hept-4-enyl]-8-(1-pyrazolyl)purine-2,6-diamine IUPAC Name: 9-[(E)-hept-4-enyl]-8-pyrazol-1-ylpurine-2,6-diamine Traditional Name: [2-amino-9-[(E)-hept-4-enyl]-8-pyrazol-1-yl-purin-6-yl]amine Formula: C15H20N8 MolecularWeight: 312.3729

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CCCCN1C2=C(C(=NC(=N2)N)N)N=C1N3C=CC=N3

Isomeric SMILES

CC/C=C/CCCN1C2=C(C(=NC(=N2)N)N)N=C1N3C=CC=N3

InChI

InChI=1S/C15H20N8/c1-2-3-4-5-6-9-22-13-11(12(16)20-14(17)21-13)19-15(22)23-10-7-8-18-23/h3-4,7-8,10H,2,5-6,9H2,1H3,(H4,16,17,20,21)/b4-3+