3-[(2S)-1-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]piperidin-1-ium-2-yl]pyridine

Systemtic Name: 3-[(2S)-1-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]piperidin-1-ium-2-yl]pyridine Openeye Name: 3-[(2S)-1-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]piperidin-1-ium-2-yl]pyridine CAS Name: 3-[(2S)-1-[[3-butyl-2-(cyclobutylmethylsulfonyl)-4-imidazolyl]methyl]-2-piperidin-1-iumyl]pyridine IUPAC Name: 3-[(2S)-1-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]piperidin-1-ium-2-yl]pyridine Traditional Name: 3-[(2S)-1-[[3-butyl-2-(cyclobutylmethylsulfonyl)imidazol-4-yl]methyl]piperidin-1-ium-2-yl]pyridine Formula: C23H35N4O2S+ MolecularWeight: 431.6146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CN=C1S(=O)(=O)CC2CCC2)C[NH+]3CCCCC3C4=CN=CC=C4

Isomeric SMILES

CCCCN1C(=CN=C1S(=O)(=O)CC2CCC2)C[NH+]3CCCC[C@H]3C4=CN=CC=C4

InChI

InChI=1S/C23H34N4O2S/c1-2-3-14-27-21(16-25-23(27)30(28,29)18-19-8-6-9-19)17-26-13-5-4-11-22(26)20-10-7-12-24-15-20/h7,10,12,15-16,19,22H,2-6,8-9,11,13-14,17-18H2,1H3/p+1/t22-/m0/s1