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

Systemtic Name: 9-cyclohexyl-2-phenyl-6-(phenylmethyl)sulfonyl-purine Openeye Name: 6-benzylsulfonyl-9-cyclohexyl-2-phenyl-purine CAS Name: 9-cyclohexyl-2-phenyl-6-(phenylmethyl)sulfonylpurine IUPAC Name: 6-benzylsulfonyl-9-cyclohexyl-2-phenylpurine Traditional Name: 6-benzylsulfonyl-9-cyclohexyl-2-phenyl-purine Formula: C24H24N4O2S MolecularWeight: 432.53796

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C=NC3=C2N=C(N=C3S(=O)(=O)CC4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)N2C=NC3=C2N=C(N=C3S(=O)(=O)CC4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C24H24N4O2S/c29-31(30,16-18-10-4-1-5-11-18)24-21-23(26-22(27-24)19-12-6-2-7-13-19)28(17-25-21)20-14-8-3-9-15-20/h1-2,4-7,10-13,17,20H,3,8-9,14-16H2