N2-decyl-9-ethyl-8-pyrazol-1-yl-purine-2,6-diamine

Systemtic Name: N2-decyl-9-ethyl-8-pyrazol-1-yl-purine-2,6-diamine Openeye Name: N2-decyl-9-ethyl-8-pyrazol-1-yl-purine-2,6-diamine CAS Name: N2-decyl-9-ethyl-8-(1-pyrazolyl)purine-2,6-diamine IUPAC Name: 2-N-decyl-9-ethyl-8-pyrazol-1-ylpurine-2,6-diamine Traditional Name: (6-amino-9-ethyl-8-pyrazol-1-yl-purin-2-yl)-decyl-amine Formula: C20H32N8 MolecularWeight: 384.52168

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCNC1=NC2=C(C(=N1)N)N=C(N2CC)N3C=CC=N3

Isomeric SMILES

CCCCCCCCCCNC1=NC2=C(C(=N1)N)N=C(N2CC)N3C=CC=N3

InChI

InChI=1S/C20H32N8/c1-3-5-6-7-8-9-10-11-13-22-19-25-17(21)16-18(26-19)27(4-2)20(24-16)28-15-12-14-23-28/h12,14-15H,3-11,13H2,1-2H3,(H3,21,22,25,26)