[2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl-[(1-methylimidazol-2-yl)methyl]-propan-2-yl-azanium

Systemtic Name: [2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl-[(1-methylimidazol-2-yl)methyl]-propan-2-yl-azanium Openeye Name: [2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl-isopropyl-[(1-methylimidazol-2-yl)methyl]ammonium CAS Name: [2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)-4-imidazolyl]methyl-[(1-methyl-2-imidazolyl)methyl]-propan-2-ylammonium IUPAC Name: [2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl-[(1-methylimidazol-2-yl)methyl]-propan-2-ylazanium Traditional Name: [2-(cyclohexylmethylsulfonyl)-3-(2-methoxyethyl)imidazol-4-yl]methyl-isopropyl-[(1-methylimidazol-2-yl)methyl]ammonium Formula: C22H38N5O3S+ MolecularWeight: 452.63382

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CC1=CN=C(N1CCOC)S(=O)(=O)CC2CCCCC2)CC3=NC=CN3C

Isomeric SMILES

CC(C)[NH+](CC1=CN=C(N1CCOC)S(=O)(=O)CC2CCCCC2)CC3=NC=CN3C

InChI

InChI=1S/C22H37N5O3S/c1-18(2)26(16-21-23-10-11-25(21)3)15-20-14-24-22(27(20)12-13-30-4)31(28,29)17-19-8-6-5-7-9-19/h10-11,14,18-19H,5-9,12-13,15-17H2,1-4H3/p+1