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1-[2-cycloheptylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]-N-methyl-N-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]methanamine
1-[2-cycloheptylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]-N-methyl-N-[(5-methyl-1H-imidazol-3-ium-2-yl)methyl]methanamine
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Descriptors Computed from Structure
Canonical SMILES:
CC1=C[NH+]=C(N1)CN(C)CC2=CN=C(N2CCOC)S(=O)(=O)C3CCCCCC3
Isomeric SMILES
CC1=C[NH+]=C(N1)CN(C)CC2=CN=C(N2CCOC)S(=O)(=O)C3CCCCCC3
InChI
InChI=1S/C20H33N5O3S/c1-16-12-21-19(23-16)15-24(2)14-17-13-22-20(25(17)10-11-28-3)29(26,27)18-8-6-4-5-7-9-18/h12-13,18H,4-11,14-15H2,1-3H3,(H,21,23)/p+1
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- [4-(4-cyclopropyl-1,2,3-triazol-1-yl)piperidin-1-yl]-(5-ethylthiophen-3-yl)methanone
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