8-bromanyl-9-ethyl-N2-[1-(4-methoxyphenyl)ethyl]purine-2,6-diamine

Systemtic Name: 8-bromanyl-9-ethyl-N2-[1-(4-methoxyphenyl)ethyl]purine-2,6-diamine Openeye Name: 8-bromo-9-ethyl-N2-[1-(4-methoxyphenyl)ethyl]purine-2,6-diamine CAS Name: 8-bromo-9-ethyl-N2-[1-(4-methoxyphenyl)ethyl]purine-2,6-diamine IUPAC Name: 8-bromo-9-ethyl-2-N-[1-(4-methoxyphenyl)ethyl]purine-2,6-diamine Traditional Name: (6-amino-8-bromo-9-ethyl-purin-2-yl)-[1-(4-methoxyphenyl)ethyl]amine Formula: C16H19BrN6O MolecularWeight: 391.26566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19BrN6O/c1-4-23-14-12(20-15(23)17)13(18)21-16(22-14)19-9(2)10-5-7-11(24-3)8-6-10/h5-9H,4H2,1-3H3,(H3,18,19,21,22)