8-bromanyl-N2-[2-(3,4-dimethoxyphenyl)ethyl]-9-ethyl-purine-2,6-diamine

Systemtic Name: 8-bromanyl-N2-[2-(3,4-dimethoxyphenyl)ethyl]-9-ethyl-purine-2,6-diamine Openeye Name: 8-bromo-N2-[2-(3,4-dimethoxyphenyl)ethyl]-9-ethyl-purine-2,6-diamine CAS Name: 8-bromo-N2-[2-(3,4-dimethoxyphenyl)ethyl]-9-ethylpurine-2,6-diamine IUPAC Name: 8-bromo-2-N-[2-(3,4-dimethoxyphenyl)ethyl]-9-ethylpurine-2,6-diamine Traditional Name: (6-amino-8-bromo-9-ethyl-purin-2-yl)-homoveratryl-amine Formula: C17H21BrN6O2 MolecularWeight: 421.29164

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C(=NC(=N2)NCCC3=CC(=C(C=C3)OC)OC)N)N=C1Br

Isomeric SMILES

CCN1C2=C(C(=NC(=N2)NCCC3=CC(=C(C=C3)OC)OC)N)N=C1Br

InChI

InChI=1S/C17H21BrN6O2/c1-4-24-15-13(21-16(24)18)14(19)22-17(23-15)20-8-7-10-5-6-11(25-2)12(9-10)26-3/h5-6,9H,4,7-8H2,1-3H3,(H3,19,20,22,23)