ethyl-[[3-(2-methoxyethyl)-2-(3-methylbutylsulfonyl)imidazol-4-yl]methyl]-(pyridin-4-ylmethyl)azanium

Systemtic Name: ethyl-[[3-(2-methoxyethyl)-2-(3-methylbutylsulfonyl)imidazol-4-yl]methyl]-(pyridin-4-ylmethyl)azanium Openeye Name: ethyl-[[2-isopentylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]-(4-pyridylmethyl)ammonium CAS Name: ethyl-[[3-(2-methoxyethyl)-2-(3-methylbutylsulfonyl)-4-imidazolyl]methyl]-(pyridin-4-ylmethyl)ammonium IUPAC Name: ethyl-[[3-(2-methoxyethyl)-2-(3-methylbutylsulfonyl)imidazol-4-yl]methyl]-(pyridin-4-ylmethyl)azanium Traditional Name: ethyl-[[2-isoamylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]-(4-pyridylmethyl)ammonium Formula: C20H33N4O3S+ MolecularWeight: 409.56602

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=NC=C1)CC2=CN=C(N2CCOC)S(=O)(=O)CCC(C)C

Isomeric SMILES

CC[NH+](CC1=CC=NC=C1)CC2=CN=C(N2CCOC)S(=O)(=O)CCC(C)C

InChI

InChI=1S/C20H32N4O3S/c1-5-23(15-18-6-9-21-10-7-18)16-19-14-22-20(24(19)11-12-27-4)28(25,26)13-8-17(2)3/h6-7,9-10,14,17H,5,8,11-13,15-16H2,1-4H3/p+1