(3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl-methyl-[[1-(2-methylphenyl)pyrazol-4-yl]methyl]azanium

Systemtic Name: (3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl-methyl-[[1-(2-methylphenyl)pyrazol-4-yl]methyl]azanium Openeye Name: (3-butyl-2-ethylsulfonyl-imidazol-4-yl)methyl-methyl-[[1-(o-tolyl)pyrazol-4-yl]methyl]ammonium CAS Name: (3-butyl-2-ethylsulfonyl-4-imidazolyl)methyl-methyl-[[1-(2-methylphenyl)-4-pyrazolyl]methyl]ammonium IUPAC Name: (3-butyl-2-ethylsulfonylimidazol-4-yl)methyl-methyl-[[1-(2-methylphenyl)pyrazol-4-yl]methyl]azanium Traditional Name: (3-butyl-2-esyl-imidazol-4-yl)methyl-methyl-[[1-(o-tolyl)pyrazol-4-yl]methyl]ammonium Formula: C22H32N5O2S+ MolecularWeight: 430.58678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1S(=O)(=O)CC)C[NH+](C)CC2=CN(N=C2)C3=CC=CC=C3C

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)CC)C[NH+](C)CC2=CN(N=C2)C3=CC=CC=C3C

InChI

InChI=1S/C22H31N5O2S/c1-5-7-12-26-20(14-23-22(26)30(28,29)6-2)17-25(4)15-19-13-24-27(16-19)21-11-9-8-10-18(21)3/h8-11,13-14,16H,5-7,12,15,17H2,1-4H3/p+1