(3-butyl-2-cyclohexylsulfonyl-imidazol-4-yl)methyl-methyl-(2-pyridin-2-ylethyl)azanium

Systemtic Name: (3-butyl-2-cyclohexylsulfonyl-imidazol-4-yl)methyl-methyl-(2-pyridin-2-ylethyl)azanium Openeye Name: (3-butyl-2-cyclohexylsulfonyl-imidazol-4-yl)methyl-methyl-[2-(2-pyridyl)ethyl]ammonium CAS Name: (3-butyl-2-cyclohexylsulfonyl-4-imidazolyl)methyl-methyl-[2-(2-pyridinyl)ethyl]ammonium IUPAC Name: (3-butyl-2-cyclohexylsulfonylimidazol-4-yl)methyl-methyl-(2-pyridin-2-ylethyl)azanium Traditional Name: (3-butyl-2-cyclohexylsulfonyl-imidazol-4-yl)methyl-methyl-[2-(2-pyridyl)ethyl]ammonium Formula: C22H35N4O2S+ MolecularWeight: 419.6039

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1S(=O)(=O)C2CCCCC2)C[NH+](C)CCC3=CC=CC=N3

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)C2CCCCC2)C[NH+](C)CCC3=CC=CC=N3

InChI

InChI=1S/C22H34N4O2S/c1-3-4-15-26-20(18-25(2)16-13-19-10-8-9-14-23-19)17-24-22(26)29(27,28)21-11-6-5-7-12-21/h8-10,14,17,21H,3-7,11-13,15-16,18H2,1-2H3/p+1