N-methyl-1-[3-(2-methylpropyl)-2-methylsulfonyl-imidazol-4-yl]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]methanamine

Systemtic Name: N-methyl-1-[3-(2-methylpropyl)-2-methylsulfonyl-imidazol-4-yl]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]methanamine Openeye Name: 1-(3-isobutyl-2-methylsulfonyl-imidazol-4-yl)-N-methyl-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]methanamine CAS Name: N-methyl-1-[3-(2-methylpropyl)-2-methylsulfonyl-4-imidazolyl]-N-[[1-(1-piperidin-1-iumyl)cyclohexyl]methyl]methanamine IUPAC Name: N-methyl-1-[3-(2-methylpropyl)-2-methylsulfonylimidazol-4-yl]-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]methanamine Traditional Name: (3-isobutyl-2-mesyl-imidazol-4-yl)methyl-methyl-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]amine Formula: C22H41N4O2S+ MolecularWeight: 425.65154

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=CN=C1S(=O)(=O)C)CN(C)CC2(CCCCC2)[NH+]3CCCCC3

Isomeric SMILES

CC(C)CN1C(=CN=C1S(=O)(=O)C)CN(C)CC2(CCCCC2)[NH+]3CCCCC3

InChI

InChI=1S/C22H40N4O2S/c1-19(2)16-26-20(15-23-21(26)29(4,27)28)17-24(3)18-22(11-7-5-8-12-22)25-13-9-6-10-14-25/h15,19H,5-14,16-18H2,1-4H3/p+1