6-bromanyl-9-[(2-chloranyl-4-methoxy-3,5-dimethyl-phenyl)methyl]purin-2-amine

Systemtic Name: 6-bromanyl-9-[(2-chloranyl-4-methoxy-3,5-dimethyl-phenyl)methyl]purin-2-amine Openeye Name: 6-bromo-9-[(2-chloro-4-methoxy-3,5-dimethyl-phenyl)methyl]purin-2-amine CAS Name: 6-bromo-9-[(2-chloro-4-methoxy-3,5-dimethylphenyl)methyl]-2-purinamine IUPAC Name: 6-bromo-9-[(2-chloro-4-methoxy-3,5-dimethylphenyl)methyl]purin-2-amine Traditional Name: [6-bromo-9-(2-chloro-4-methoxy-3,5-dimethyl-benzyl)purin-2-yl]amine Formula: C15H15BrClN5O MolecularWeight: 396.6695

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1OC)C)Cl)CN2C=NC3=C2N=C(N=C3Br)N

Isomeric SMILES

CC1=CC(=C(C(=C1OC)C)Cl)CN2C=NC3=C2N=C(N=C3Br)N

InChI

InChI=1S/C15H15BrClN5O/c1-7-4-9(10(17)8(2)12(7)23-3)5-22-6-19-11-13(16)20-15(18)21-14(11)22/h4,6H,5H2,1-3H3,(H2,18,20,21)