methyl-[[3-(2-methylpropyl)-2-methylsulfonyl-imidazol-4-yl]methyl]-(quinolin-4-ylmethyl)azanium

Systemtic Name: methyl-[[3-(2-methylpropyl)-2-methylsulfonyl-imidazol-4-yl]methyl]-(quinolin-4-ylmethyl)azanium Openeye Name: (3-isobutyl-2-methylsulfonyl-imidazol-4-yl)methyl-methyl-(4-quinolylmethyl)ammonium CAS Name: methyl-[[3-(2-methylpropyl)-2-methylsulfonyl-4-imidazolyl]methyl]-(4-quinolinylmethyl)ammonium IUPAC Name: methyl-[[3-(2-methylpropyl)-2-methylsulfonylimidazol-4-yl]methyl]-(quinolin-4-ylmethyl)azanium Traditional Name: (3-isobutyl-2-mesyl-imidazol-4-yl)methyl-methyl-(4-quinolylmethyl)ammonium Formula: C20H27N4O2S+ MolecularWeight: 387.51898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=CN=C1S(=O)(=O)C)C[NH+](C)CC2=CC=NC3=CC=CC=C23

Isomeric SMILES

CC(C)CN1C(=CN=C1S(=O)(=O)C)C[NH+](C)CC2=CC=NC3=CC=CC=C23

InChI

InChI=1S/C20H26N4O2S/c1-15(2)12-24-17(11-22-20(24)27(4,25)26)14-23(3)13-16-9-10-21-19-8-6-5-7-18(16)19/h5-11,15H,12-14H2,1-4H3/p+1