2-[(2S)-1-[[2-ethylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]pyrrolidin-1-ium-2-yl]pyridine

Systemtic Name: 2-[(2S)-1-[[2-ethylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]pyrrolidin-1-ium-2-yl]pyridine Openeye Name: 2-[(2S)-1-[[2-ethylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]pyrrolidin-1-ium-2-yl]pyridine CAS Name: 2-[(2S)-1-[[2-ethylsulfonyl-3-(2-methoxyethyl)-4-imidazolyl]methyl]-2-pyrrolidin-1-iumyl]pyridine IUPAC Name: 2-[(2S)-1-[[2-ethylsulfonyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]pyrrolidin-1-ium-2-yl]pyridine Traditional Name: 2-[(2S)-1-[[2-esyl-3-(2-methoxyethyl)imidazol-4-yl]methyl]pyrrolidin-1-ium-2-yl]pyridine Formula: C18H27N4O3S+ MolecularWeight: 379.49698

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(N1CCOC)C[NH+]2CCCC2C3=CC=CC=N3

Isomeric SMILES

CCS(=O)(=O)C1=NC=C(N1CCOC)C[NH+]2CCC[C@H]2C3=CC=CC=N3

InChI

InChI=1S/C18H26N4O3S/c1-3-26(23,24)18-20-13-15(22(18)11-12-25-2)14-21-10-6-8-17(21)16-7-4-5-9-19-16/h4-5,7,9,13,17H,3,6,8,10-12,14H2,1-2H3/p+1/t17-/m0/s1