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

Systemtic Name: 2-[(2S)-1-[(2-ethylsulfonyl-3-phenethyl-imidazol-4-yl)methyl]pyrrolidin-1-ium-2-yl]pyridine Openeye Name: 2-[(2S)-1-[(2-ethylsulfonyl-3-phenethyl-imidazol-4-yl)methyl]pyrrolidin-1-ium-2-yl]pyridine CAS Name: 2-[(2S)-1-[(2-ethylsulfonyl-3-phenethyl-4-imidazolyl)methyl]-2-pyrrolidin-1-iumyl]pyridine IUPAC Name: 2-[(2S)-1-[(2-ethylsulfonyl-3-phenethylimidazol-4-yl)methyl]pyrrolidin-1-ium-2-yl]pyridine Traditional Name: 2-[(2S)-1-[(2-esyl-3-phenethyl-imidazol-4-yl)methyl]pyrrolidin-1-ium-2-yl]pyridine Formula: C23H29N4O2S+ MolecularWeight: 425.56696

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(N1CCC2=CC=CC=C2)C[NH+]3CCCC3C4=CC=CC=N4

Isomeric SMILES

CCS(=O)(=O)C1=NC=C(N1CCC2=CC=CC=C2)C[NH+]3CCC[C@H]3C4=CC=CC=N4

InChI

InChI=1S/C23H28N4O2S/c1-2-30(28,29)23-25-17-20(27(23)16-13-19-9-4-3-5-10-19)18-26-15-8-12-22(26)21-11-6-7-14-24-21/h3-7,9-11,14,17,22H,2,8,12-13,15-16,18H2,1H3/p+1/t22-/m0/s1