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

Systemtic Name: 6-chloranyl-8-[8-iodanyl-9-(phenylmethyl)purin-6-yl]-9-(phenylmethyl)purine Openeye Name: 9-benzyl-6-(9-benzyl-6-chloro-purin-8-yl)-8-iodo-purine CAS Name: 6-chloro-8-[8-iodo-9-(phenylmethyl)-6-purinyl]-9-(phenylmethyl)purine IUPAC Name: 9-benzyl-6-(9-benzyl-6-chloropurin-8-yl)-8-iodopurine Traditional Name: 9-benzyl-6-(9-benzyl-6-chloro-purin-8-yl)-8-iodo-purine Formula: C24H16ClIN8 MolecularWeight: 578.79491

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C(=NC=N3)Cl)N=C2C4=C5C(=NC=N4)N(C(=N5)I)CC6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C(=NC=N3)Cl)N=C2C4=C5C(=NC=N4)N(C(=N5)I)CC6=CC=CC=C6

InChI

InChI=1S/C24H16ClIN8/c25-20-19-22(30-14-28-20)33(11-15-7-3-1-4-8-15)23(31-19)17-18-21(29-13-27-17)34(24(26)32-18)12-16-9-5-2-6-10-16/h1-10,13-14H,11-12H2