9-(phenylmethyl)-6-[2-[9-(phenylmethyl)purin-6-yl]sulfanylethylsulfanyl]purine

Systemtic Name: 9-(phenylmethyl)-6-[2-[9-(phenylmethyl)purin-6-yl]sulfanylethylsulfanyl]purine Openeye Name: 9-benzyl-6-[2-(9-benzylpurin-6-yl)sulfanylethylsulfanyl]purine CAS Name: 9-(phenylmethyl)-6-[2-[[9-(phenylmethyl)-6-purinyl]thio]ethylthio]purine IUPAC Name: 9-benzyl-6-[2-(9-benzylpurin-6-yl)sulfanylethylsulfanyl]purine Traditional Name: 9-benzyl-6-[2-[(9-benzylpurin-6-yl)thio]ethylthio]purine Formula: C26H22N8S2 MolecularWeight: 510.63648

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C2N=CN=C3SCCSC4=NC=NC5=C4N=CN5CC6=CC=CC=C6

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C2N=CN=C3SCCSC4=NC=NC5=C4N=CN5CC6=CC=CC=C6

InChI

InChI=1S/C26H22N8S2/c1-3-7-19(8-4-1)13-33-17-31-21-23(33)27-15-29-25(21)35-11-12-36-26-22-24(28-16-30-26)34(18-32-22)14-20-9-5-2-6-10-20/h1-10,15-18H,11-14H2