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

Systemtic Name: 9-[(2-bromanyl-4-methoxy-3,5-dimethyl-phenyl)methyl]-6-chloranyl-purin-2-amine Openeye Name: 9-[(2-bromo-4-methoxy-3,5-dimethyl-phenyl)methyl]-6-chloro-purin-2-amine CAS Name: 9-[(2-bromo-4-methoxy-3,5-dimethylphenyl)methyl]-6-chloro-2-purinamine IUPAC Name: 9-[(2-bromo-4-methoxy-3,5-dimethylphenyl)methyl]-6-chloropurin-2-amine Traditional Name: [9-(2-bromo-4-methoxy-3,5-dimethyl-benzyl)-6-chloro-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)Br)CN2C=NC3=C2N=C(N=C3Cl)N

Isomeric SMILES

CC1=CC(=C(C(=C1OC)C)Br)CN2C=NC3=C2N=C(N=C3Cl)N

InChI

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