N-[9-[(2-bromanyl-3,4,5-trimethoxy-phenyl)methyl]-6-chloranyl-purin-2-yl]-N-methyl-ethanamide

Systemtic Name: N-[9-[(2-bromanyl-3,4,5-trimethoxy-phenyl)methyl]-6-chloranyl-purin-2-yl]-N-methyl-ethanamide Openeye Name: N-[9-[(2-bromo-3,4,5-trimethoxy-phenyl)methyl]-6-chloro-purin-2-yl]-N-methyl-acetamide CAS Name: N-[9-[(2-bromo-3,4,5-trimethoxyphenyl)methyl]-6-chloro-2-purinyl]-N-methylacetamide IUPAC Name: N-[9-[(2-bromo-3,4,5-trimethoxyphenyl)methyl]-6-chloropurin-2-yl]-N-methylacetamide Traditional Name: N-[9-(2-bromo-3,4,5-trimethoxy-benzyl)-6-chloro-purin-2-yl]-N-methyl-acetamide Formula: C18H19BrClN5O4 MolecularWeight: 484.73156

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C)C1=NC2=C(C(=N1)Cl)N=CN2CC3=CC(=C(C(=C3Br)OC)OC)OC

Isomeric SMILES

CC(=O)N(C)C1=NC2=C(C(=N1)Cl)N=CN2CC3=CC(=C(C(=C3Br)OC)OC)OC

InChI

InChI=1S/C18H19BrClN5O4/c1-9(26)24(2)18-22-16(20)13-17(23-18)25(8-21-13)7-10-6-11(27-3)14(28-4)15(29-5)12(10)19/h6,8H,7H2,1-5H3