[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl-methyl-[(3S)-3-pyrrolidin-1-ium-1-ylbutyl]azanium

Systemtic Name: [3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl-methyl-[(3S)-3-pyrrolidin-1-ium-1-ylbutyl]azanium Openeye Name: [3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl-methyl-[(3S)-3-pyrrolidin-1-ium-1-ylbutyl]ammonium CAS Name: [3-butyl-2-(cyclobutylmethylsulfonyl)-4-imidazolyl]methyl-methyl-[(3S)-3-(1-pyrrolidin-1-iumyl)butyl]ammonium IUPAC Name: [3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl-methyl-[(3S)-3-pyrrolidin-1-ium-1-ylbutyl]azanium Traditional Name: [3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl-methyl-[(3S)-3-pyrrolidin-1-ium-1-ylbutyl]ammonium Formula: C22H42N4O2S+2 MolecularWeight: 426.65948

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1S(=O)(=O)CC2CCC2)C[NH+](C)CCC(C)[NH+]3CCCC3

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)CC2CCC2)C[NH+](C)CC[C@H](C)[NH+]3CCCC3

InChI

InChI=1S/C22H40N4O2S/c1-4-5-14-26-21(16-23-22(26)29(27,28)18-20-9-8-10-20)17-24(3)15-11-19(2)25-12-6-7-13-25/h16,19-20H,4-15,17-18H2,1-3H3/p+2/t19-/m0/s1