(3-butyl-2-cyclohexylsulfonyl-imidazol-4-yl)methyl-methyl-[2-(1-methylpyrazol-4-yl)ethyl]azanium

Systemtic Name: (3-butyl-2-cyclohexylsulfonyl-imidazol-4-yl)methyl-methyl-[2-(1-methylpyrazol-4-yl)ethyl]azanium Openeye Name: (3-butyl-2-cyclohexylsulfonyl-imidazol-4-yl)methyl-methyl-[2-(1-methylpyrazol-4-yl)ethyl]ammonium CAS Name: (3-butyl-2-cyclohexylsulfonyl-4-imidazolyl)methyl-methyl-[2-(1-methyl-4-pyrazolyl)ethyl]ammonium IUPAC Name: (3-butyl-2-cyclohexylsulfonylimidazol-4-yl)methyl-methyl-[2-(1-methylpyrazol-4-yl)ethyl]azanium Traditional Name: (3-butyl-2-cyclohexylsulfonyl-imidazol-4-yl)methyl-methyl-[2-(1-methylpyrazol-4-yl)ethyl]ammonium Formula: C21H36N5O2S+ MolecularWeight: 422.60784

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1S(=O)(=O)C2CCCCC2)C[NH+](C)CCC3=CN(N=C3)C

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)C2CCCCC2)C[NH+](C)CCC3=CN(N=C3)C

InChI

InChI=1S/C21H35N5O2S/c1-4-5-12-26-19(17-24(2)13-11-18-14-23-25(3)16-18)15-22-21(26)29(27,28)20-9-7-6-8-10-20/h14-16,20H,4-13,17H2,1-3H3/p+1