N,9-bis(3-chloranyl-4-methoxy-phenyl)-8-ethyl-6-methyl-purin-2-amine

Systemtic Name: N,9-bis(3-chloranyl-4-methoxy-phenyl)-8-ethyl-6-methyl-purin-2-amine Openeye Name: N,9-bis(3-chloro-4-methoxy-phenyl)-8-ethyl-6-methyl-purin-2-amine CAS Name: N,9-bis(3-chloro-4-methoxyphenyl)-8-ethyl-6-methyl-2-purinamine IUPAC Name: N,9-bis(3-chloro-4-methoxyphenyl)-8-ethyl-6-methylpurin-2-amine Traditional Name: (3-chloro-4-methoxy-phenyl)-[9-(3-chloro-4-methoxy-phenyl)-8-ethyl-6-methyl-purin-2-yl]amine Formula: C22H21Cl2N5O2 MolecularWeight: 458.34044

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N=C(N=C2N1C3=CC(=C(C=C3)OC)Cl)NC4=CC(=C(C=C4)OC)Cl)C

Isomeric SMILES

CCC1=NC2=C(N=C(N=C2N1C3=CC(=C(C=C3)OC)Cl)NC4=CC(=C(C=C4)OC)Cl)C

InChI

InChI=1S/C22H21Cl2N5O2/c1-5-19-27-20-12(2)25-22(26-13-6-8-17(30-3)15(23)10-13)28-21(20)29(19)14-7-9-18(31-4)16(24)11-14/h6-11H,5H2,1-4H3,(H,25,26,28)