2-phenyl-9-(phenylmethyl)-6-(phenylmethyl)sulfonyl-purine

Systemtic Name: 2-phenyl-9-(phenylmethyl)-6-(phenylmethyl)sulfonyl-purine Openeye Name: 9-benzyl-6-benzylsulfonyl-2-phenyl-purine CAS Name: 2-phenyl-9-(phenylmethyl)-6-(phenylmethyl)sulfonylpurine IUPAC Name: 9-benzyl-6-benzylsulfonyl-2-phenylpurine Traditional Name: 9-benzyl-6-benzylsulfonyl-2-phenyl-purine Formula: C25H20N4O2S MolecularWeight: 440.5169

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=NC3=C2N=C(N=C3S(=O)(=O)CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CN2C=NC3=C2N=C(N=C3S(=O)(=O)CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C25H20N4O2S/c30-32(31,17-20-12-6-2-7-13-20)25-22-24(27-23(28-25)21-14-8-3-9-15-21)29(18-26-22)16-19-10-4-1-5-11-19/h1-15,18H,16-17H2