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

Systemtic Name: 2-hydroxyethyl-[[3-(2-methylpropyl)-2-(phenylmethyl)sulfonyl-imidazol-4-yl]methyl]-propan-2-yl-azanium Openeye Name: (2-benzylsulfonyl-3-isobutyl-imidazol-4-yl)methyl-(2-hydroxyethyl)-isopropyl-ammonium CAS Name: 2-hydroxyethyl-[[3-(2-methylpropyl)-2-(phenylmethyl)sulfonyl-4-imidazolyl]methyl]-propan-2-ylammonium IUPAC Name: [2-benzylsulfonyl-3-(2-methylpropyl)imidazol-4-yl]methyl-(2-hydroxyethyl)-propan-2-ylazanium Traditional Name: (2-benzylsulfonyl-3-isobutyl-imidazol-4-yl)methyl-(2-hydroxyethyl)-isopropyl-ammonium Formula: C20H32N3O3S+ MolecularWeight: 394.55138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=CN=C1S(=O)(=O)CC2=CC=CC=C2)C[NH+](CCO)C(C)C

Isomeric SMILES

CC(C)CN1C(=CN=C1S(=O)(=O)CC2=CC=CC=C2)C[NH+](CCO)C(C)C

InChI

InChI=1S/C20H31N3O3S/c1-16(2)13-23-19(14-22(10-11-24)17(3)4)12-21-20(23)27(25,26)15-18-8-6-5-7-9-18/h5-9,12,16-17,24H,10-11,13-15H2,1-4H3/p+1