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6-chloranyl-9-(phenylmethyl)-8-[9-(phenylmethyl)purin-6-yl]purine

6-chloranyl-9-(phenylmethyl)-8-[9-(phenylmethyl)purin-6-yl]purine

Systemtic Name:6-chloranyl-9-(phenylmethyl)-8-[9-(phenylmethyl)purin-6-yl]purine
Openeye Name:9-benzyl-8-(9-benzylpurin-6-yl)-6-chloro-purine
CAS Name:6-chloro-9-(phenylmethyl)-8-[9-(phenylmethyl)-6-purinyl]purine
IUPAC Name:9-benzyl-8-(9-benzylpurin-6-yl)-6-chloropurine
Traditional Name:9-benzyl-8-(9-benzylpurin-6-yl)-6-chloro-purine
Formula: C24H17ClN8
MolecularWeight: 452.89838
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C(N=CN=C32)C4=NC5=C(N4CC6=CC=CC=C6)N=CN=C5Cl


Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C(N=CN=C32)C4=NC5=C(N4CC6=CC=CC=C6)N=CN=C5Cl


InChI

InChI=1S/C24H17ClN8/c25-21-20-23(29-14-27-21)33(12-17-9-5-2-6-10-17)24(31-20)19-18-22(28-13-26-19)32(15-30-18)11-16-7-3-1-4-8-16/h1-10,13-15H,11-12H2


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