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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1S(=O)(=O)C2CCCCC2)C[NH+](CC)CC3=CC=NC=C3

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)C2CCCCC2)C[NH+](CC)CC3=CC=NC=C3

InChI

InChI=1S/C22H34N4O2S/c1-3-5-15-26-20(18-25(4-2)17-19-11-13-23-14-12-19)16-24-22(26)29(27,28)21-9-7-6-8-10-21/h11-14,16,21H,3-10,15,17-18H2,1-2H3/p+1