1-(2-methoxyethyl)-4-[[3-(3-methylbutyl)-2-propan-2-ylsulfonyl-imidazol-4-yl]methyl]piperazin-1-ium

Systemtic Name: 1-(2-methoxyethyl)-4-[[3-(3-methylbutyl)-2-propan-2-ylsulfonyl-imidazol-4-yl]methyl]piperazin-1-ium Openeye Name: 1-[(3-isopentyl-2-isopropylsulfonyl-imidazol-4-yl)methyl]-4-(2-methoxyethyl)piperazin-4-ium CAS Name: 1-(2-methoxyethyl)-4-[[3-(3-methylbutyl)-2-propan-2-ylsulfonyl-4-imidazolyl]methyl]piperazin-1-ium IUPAC Name: 1-(2-methoxyethyl)-4-[[3-(3-methylbutyl)-2-propan-2-ylsulfonylimidazol-4-yl]methyl]piperazin-1-ium Traditional Name: 1-[(3-isoamyl-2-isopropylsulfonyl-imidazol-4-yl)methyl]-4-(2-methoxyethyl)piperazin-4-ium Formula: C19H37N4O3S+ MolecularWeight: 401.58708

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=CN=C1S(=O)(=O)C(C)C)CN2CC[NH+](CC2)CCOC

Isomeric SMILES

CC(C)CCN1C(=CN=C1S(=O)(=O)C(C)C)CN2CC[NH+](CC2)CCOC

InChI

InChI=1S/C19H36N4O3S/c1-16(2)6-7-23-18(14-20-19(23)27(24,25)17(3)4)15-22-10-8-21(9-11-22)12-13-26-5/h14,16-17H,6-13,15H2,1-5H3/p+1