8-[(2-bromanyl-5-methoxy-phenyl)methyl]-9-butyl-purin-6-amine

Systemtic Name: 8-[(2-bromanyl-5-methoxy-phenyl)methyl]-9-butyl-purin-6-amine Openeye Name: 8-[(2-bromo-5-methoxy-phenyl)methyl]-9-butyl-purin-6-amine CAS Name: 8-[(2-bromo-5-methoxyphenyl)methyl]-9-butyl-6-purinamine IUPAC Name: 8-[(2-bromo-5-methoxyphenyl)methyl]-9-butylpurin-6-amine Traditional Name: [8-(2-bromo-5-methoxy-benzyl)-9-butyl-purin-6-yl]amine Formula: C17H20BrN5O MolecularWeight: 390.2776

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=NC2=C1N=CN=C2N)CC3=C(C=CC(=C3)OC)Br

Isomeric SMILES

CCCCN1C(=NC2=C1N=CN=C2N)CC3=C(C=CC(=C3)OC)Br

InChI

InChI=1S/C17H20BrN5O/c1-3-4-7-23-14(22-15-16(19)20-10-21-17(15)23)9-11-8-12(24-2)5-6-13(11)18/h5-6,8,10H,3-4,7,9H2,1-2H3,(H2,19,20,21)