8-bromanyl-9-ethyl-N2-(phenylmethyl)purine-2,6-diamine

Systemtic Name: 8-bromanyl-9-ethyl-N2-(phenylmethyl)purine-2,6-diamine Openeye Name: N2-benzyl-8-bromo-9-ethyl-purine-2,6-diamine CAS Name: 8-bromo-9-ethyl-N2-(phenylmethyl)purine-2,6-diamine IUPAC Name: 2-N-benzyl-8-bromo-9-ethylpurine-2,6-diamine Traditional Name: (6-amino-8-bromo-9-ethyl-purin-2-yl)-benzyl-amine Formula: C14H15BrN6 MolecularWeight: 347.2131

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=NC(=N2)NCC3=CC=CC=C3)N)N=C1Br

Isomeric SMILES

CCN1C2=C(C(=NC(=N2)NCC3=CC=CC=C3)N)N=C1Br

InChI

InChI=1S/C14H15BrN6/c1-2-21-12-10(18-13(21)15)11(16)19-14(20-12)17-8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H3,16,17,19,20)