butyl-methyl-[[3-(2-methylpropyl)-2-(phenylmethyl)sulfonyl-imidazol-4-yl]methyl]azanium

Systemtic Name: butyl-methyl-[[3-(2-methylpropyl)-2-(phenylmethyl)sulfonyl-imidazol-4-yl]methyl]azanium Openeye Name: (2-benzylsulfonyl-3-isobutyl-imidazol-4-yl)methyl-butyl-methyl-ammonium CAS Name: butyl-methyl-[[3-(2-methylpropyl)-2-(phenylmethyl)sulfonyl-4-imidazolyl]methyl]ammonium IUPAC Name: [2-benzylsulfonyl-3-(2-methylpropyl)imidazol-4-yl]methyl-butyl-methylazanium Traditional Name: (2-benzylsulfonyl-3-isobutyl-imidazol-4-yl)methyl-butyl-methyl-ammonium Formula: C20H32N3O2S+ MolecularWeight: 378.55198

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Descriptors Computed from Structure

Canonical SMILES:

CCCC[NH+](C)CC1=CN=C(N1CC(C)C)S(=O)(=O)CC2=CC=CC=C2

Isomeric SMILES

CCCC[NH+](C)CC1=CN=C(N1CC(C)C)S(=O)(=O)CC2=CC=CC=C2

InChI

InChI=1S/C20H31N3O2S/c1-5-6-12-22(4)15-19-13-21-20(23(19)14-17(2)3)26(24,25)16-18-10-8-7-9-11-18/h7-11,13,17H,5-6,12,14-16H2,1-4H3/p+1