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9-(cyclohexylmethyl)-8-[(3,4,5-trimethoxyphenyl)methyl]purin-6-amine
9-(cyclohexylmethyl)-8-[(3,4,5-trimethoxyphenyl)methyl]purin-6-amine
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Descriptors Computed from Structure
Canonical SMILES:
COC1=CC(=CC(=C1OC)OC)CC2=NC3=C(N2CC4CCCCC4)N=CN=C3N
Isomeric SMILES
COC1=CC(=CC(=C1OC)OC)CC2=NC3=C(N2CC4CCCCC4)N=CN=C3N
InChI
InChI=1S/C22H29N5O3/c1-28-16-9-15(10-17(29-2)20(16)30-3)11-18-26-19-21(23)24-13-25-22(19)27(18)12-14-7-5-4-6-8-14/h9-10,13-14H,4-8,11-12H2,1-3H3,(H2,23,24,25)
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