1-[[3-(2-methoxyethyl)-2-(3-methylbutylsulfonyl)imidazol-4-yl]methyl]-4-propyl-piperazin-4-ium

Systemtic Name: 1-[[3-(2-methoxyethyl)-2-(3-methylbutylsulfonyl)imidazol-4-yl]methyl]-4-propyl-piperazin-4-ium Openeye Name: 1-[[2-isopentylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-propyl-piperazin-4-ium CAS Name: 1-[[3-(2-methoxyethyl)-2-(3-methylbutylsulfonyl)-4-imidazolyl]methyl]-4-propylpiperazin-4-ium IUPAC Name: 1-[[3-(2-methoxyethyl)-2-(3-methylbutylsulfonyl)imidazol-4-yl]methyl]-4-propylpiperazin-4-ium Traditional Name: 1-[[2-isoamylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]-4-propyl-piperazin-4-ium Formula: C19H37N4O3S+ MolecularWeight: 401.58708

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)CC2=CN=C(N2CCOC)S(=O)(=O)CCC(C)C

Isomeric SMILES

CCC[NH+]1CCN(CC1)CC2=CN=C(N2CCOC)S(=O)(=O)CCC(C)C

InChI

InChI=1S/C19H36N4O3S/c1-5-7-21-8-10-22(11-9-21)16-18-15-20-19(23(18)12-13-26-4)27(24,25)14-6-17(2)3/h15,17H,5-14,16H2,1-4H3/p+1