7-(3-bromanyl-3-methyl-butyl)-N-phenylmethoxy-purin-6-amine

Systemtic Name: 7-(3-bromanyl-3-methyl-butyl)-N-phenylmethoxy-purin-6-amine Openeye Name: N-benzyloxy-7-(3-bromo-3-methyl-butyl)purin-6-amine CAS Name: 7-(3-bromo-3-methylbutyl)-N-phenylmethoxy-6-purinamine IUPAC Name: 7-(3-bromo-3-methylbutyl)-N-phenylmethoxypurin-6-amine Traditional Name: benzoxy-[7-(3-bromo-3-methyl-butyl)purin-6-yl]amine Formula: C17H20BrN5O MolecularWeight: 390.2776

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCN1C=NC2=C1C(=NC=N2)NOCC3=CC=CC=C3)Br

Isomeric SMILES

CC(C)(CCN1C=NC2=C1C(=NC=N2)NOCC3=CC=CC=C3)Br

InChI

InChI=1S/C17H20BrN5O/c1-17(2,18)8-9-23-12-21-15-14(23)16(20-11-19-15)22-24-10-13-6-4-3-5-7-13/h3-7,11-12H,8-10H2,1-2H3,(H,19,20,22)