9-(2-methylpropyl)-N2-phenethyl-purine-2,6-diamine

Systemtic Name: 9-(2-methylpropyl)-N2-phenethyl-purine-2,6-diamine Openeye Name: 9-isobutyl-N2-phenethyl-purine-2,6-diamine CAS Name: 9-(2-methylpropyl)-N2-phenethylpurine-2,6-diamine IUPAC Name: 9-(2-methylpropyl)-2-N-phenethylpurine-2,6-diamine Traditional Name: (6-amino-9-isobutyl-purin-2-yl)-phenethyl-amine Formula: C17H22N6 MolecularWeight: 310.39678

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=NC2=C1N=C(N=C2N)NCCC3=CC=CC=C3

Isomeric SMILES

CC(C)CN1C=NC2=C1N=C(N=C2N)NCCC3=CC=CC=C3

InChI

InChI=1S/C17H22N6/c1-12(2)10-23-11-20-14-15(18)21-17(22-16(14)23)19-9-8-13-6-4-3-5-7-13/h3-7,11-12H,8-10H2,1-2H3,(H3,18,19,21,22)