N-butyl-9-(2-chloranyl-4,6-dimethoxy-phenyl)-N-ethyl-2-methyl-purin-6-amine

Systemtic Name: N-butyl-9-(2-chloranyl-4,6-dimethoxy-phenyl)-N-ethyl-2-methyl-purin-6-amine Openeye Name: N-butyl-9-(2-chloro-4,6-dimethoxy-phenyl)-N-ethyl-2-methyl-purin-6-amine CAS Name: N-butyl-9-(2-chloro-4,6-dimethoxyphenyl)-N-ethyl-2-methyl-6-purinamine IUPAC Name: N-butyl-9-(2-chloro-4,6-dimethoxyphenyl)-N-ethyl-2-methylpurin-6-amine Traditional Name: butyl-[9-(2-chloro-4,6-dimethoxy-phenyl)-2-methyl-purin-6-yl]-ethyl-amine Formula: C20H26ClN5O2 MolecularWeight: 403.90574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC)C1=NC(=NC2=C1N=CN2C3=C(C=C(C=C3Cl)OC)OC)C

Isomeric SMILES

CCCCN(CC)C1=NC(=NC2=C1N=CN2C3=C(C=C(C=C3Cl)OC)OC)C

InChI

InChI=1S/C20H26ClN5O2/c1-6-8-9-25(7-2)19-17-20(24-13(3)23-19)26(12-22-17)18-15(21)10-14(27-4)11-16(18)28-5/h10-12H,6-9H2,1-5H3