1-[4-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]piperazin-4-ium-1-yl]ethanone

Systemtic Name: 1-[4-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]piperazin-4-ium-1-yl]ethanone Openeye Name: 1-[4-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]piperazin-4-ium-1-yl]ethanone CAS Name: 1-[4-[[3-butyl-2-(cyclobutylmethylsulfonyl)-4-imidazolyl]methyl]-1-piperazin-4-iumyl]ethanone IUPAC Name: 1-[4-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]piperazin-4-ium-1-yl]ethanone Traditional Name: 1-[4-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]piperazin-4-ium-1-yl]ethanone Formula: C19H33N4O3S+ MolecularWeight: 397.55532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1S(=O)(=O)CC2CCC2)C[NH+]3CCN(CC3)C(=O)C

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)CC2CCC2)C[NH+]3CCN(CC3)C(=O)C

InChI

InChI=1S/C19H32N4O3S/c1-3-4-8-23-18(14-21-9-11-22(12-10-21)16(2)24)13-20-19(23)27(25,26)15-17-6-5-7-17/h13,17H,3-12,14-15H2,1-2H3/p+1