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2-[[2-adamantyl(ethyl)amino]methyl]-1H-[1,2,4]triazolo[4,3-a]pyridin-4-ium-3-thione
2-[[2-adamantyl(ethyl)amino]methyl]-1H-[1,2,4]triazolo[4,3-a]pyridin-4-ium-3-thione
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Descriptors Computed from Structure
Canonical SMILES:
CCN(CN1C(=S)[N+]2=CC=CC=C2N1)C3C4CC5CC(C4)CC3C5
Isomeric SMILES
CCN(CN1C(=S)[N+]2=CC=CC=C2N1)C3C4CC5CC(C4)CC3C5
InChI
InChI=1S/C19H26N4S/c1-2-21(12-23-19(24)22-6-4-3-5-17(22)20-23)18-15-8-13-7-14(10-15)11-16(18)9-13/h3-6,13-16,18H,2,7-12H2,1H3/p+1
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