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1,3-dimethyl-7-(phenylmethyl)-8-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)purine-2,6-dione
1,3-dimethyl-7-(phenylmethyl)-8-(1,2,3,4-tetrahydroisoquinolin-2-ium-2-ylmethyl)purine-2,6-dione
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Descriptors Computed from Structure
Canonical SMILES:
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)C[NH+]3CCC4=CC=CC=C4C3)CC5=CC=CC=C5
Isomeric SMILES
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)C[NH+]3CCC4=CC=CC=C4C3)CC5=CC=CC=C5
InChI
InChI=1S/C24H25N5O2/c1-26-22-21(23(30)27(2)24(26)31)29(14-17-8-4-3-5-9-17)20(25-22)16-28-13-12-18-10-6-7-11-19(18)15-28/h3-11H,12-16H2,1-2H3/p+1
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- 4-cyclohexyl-3-(4-methoxyphenyl)-5-[(2-methylphenyl)methylsulfanyl]-1,2,4-triazole
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