9-(phenylmethyl)-N2-propyl-purine-2,6-diamine

Systemtic Name: 9-(phenylmethyl)-N2-propyl-purine-2,6-diamine Openeye Name: 9-benzyl-N2-propyl-purine-2,6-diamine CAS Name: 9-(phenylmethyl)-N2-propylpurine-2,6-diamine IUPAC Name: 9-benzyl-2-N-propylpurine-2,6-diamine Traditional Name: (6-amino-9-benzyl-purin-2-yl)-propyl-amine Formula: C15H18N6 MolecularWeight: 282.34362

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NC2=C(C(=N1)N)N=CN2CC3=CC=CC=C3

Isomeric SMILES

CCCNC1=NC2=C(C(=N1)N)N=CN2CC3=CC=CC=C3

InChI

InChI=1S/C15H18N6/c1-2-8-17-15-19-13(16)12-14(20-15)21(10-18-12)9-11-6-4-3-5-7-11/h3-7,10H,2,8-9H2,1H3,(H3,16,17,19,20)