N8-(phenylmethyl)-5H-purine-6,8-diamine

Systemtic Name: N8-(phenylmethyl)-5H-purine-6,8-diamine Openeye Name: N8-benzyl-5H-purine-6,8-diamine CAS Name: N8-(phenylmethyl)-5H-purine-6,8-diamine IUPAC Name: 8-N-benzyl-5H-purine-6,8-diamine Traditional Name: (6-amino-5H-purin-8-yl)-benzyl-amine Formula: C12H12N6 MolecularWeight: 240.26388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC2=NC3C(=NC=NC3=N2)N

Isomeric SMILES

C1=CC=C(C=C1)CNC2=NC3C(=NC=NC3=N2)N

InChI

InChI=1S/C12H12N6/c13-10-9-11(16-7-15-10)18-12(17-9)14-6-8-4-2-1-3-5-8/h1-5,7,9H,6H2,(H3,13,14,15,16,17,18)