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6-[(2,4-dichlorophenyl)methylsulfanyl]-9-(2-methylpropyl)-7H-purin-9-ium-2-amine
6-[(2,4-dichlorophenyl)methylsulfanyl]-9-(2-methylpropyl)-7H-purin-9-ium-2-amine
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Canonical SMILES:
CC(C)C[N+]1=CNC2=C1N=C(N=C2SCC3=C(C=C(C=C3)Cl)Cl)N
Isomeric SMILES
CC(C)C[N+]1=CNC2=C1N=C(N=C2SCC3=C(C=C(C=C3)Cl)Cl)N
InChI
InChI=1S/C16H17Cl2N5S/c1-9(2)6-23-8-20-13-14(23)21-16(19)22-15(13)24-7-10-3-4-11(17)5-12(10)18/h3-5,8-9H,6-7H2,1-2H3,(H2,19,21,22)/p+1
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