N-[(2-ethylsulfonyl-3-phenethyl-imidazol-4-yl)methyl]-N-methyl-1-[(2R)-1-methylpyrrolidin-1-ium-2-yl]methanamine

Systemtic Name: N-[(2-ethylsulfonyl-3-phenethyl-imidazol-4-yl)methyl]-N-methyl-1-[(2R)-1-methylpyrrolidin-1-ium-2-yl]methanamine Openeye Name: N-[(2-ethylsulfonyl-3-phenethyl-imidazol-4-yl)methyl]-N-methyl-1-[(2R)-1-methylpyrrolidin-1-ium-2-yl]methanamine CAS Name: N-[(2-ethylsulfonyl-3-phenethyl-4-imidazolyl)methyl]-N-methyl-1-[(2R)-1-methyl-2-pyrrolidin-1-iumyl]methanamine IUPAC Name: N-[(2-ethylsulfonyl-3-phenethylimidazol-4-yl)methyl]-N-methyl-1-[(2R)-1-methylpyrrolidin-1-ium-2-yl]methanamine Traditional Name: (2-esyl-3-phenethyl-imidazol-4-yl)methyl-methyl-[[(2R)-1-methylpyrrolidin-1-ium-2-yl]methyl]amine Formula: C21H33N4O2S+ MolecularWeight: 405.57732

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NC=C(N1CCC2=CC=CC=C2)CN(C)CC3CCC[NH+]3C

Isomeric SMILES

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

InChI

InChI=1S/C21H32N4O2S/c1-4-28(26,27)21-22-15-20(17-23(2)16-19-11-8-13-24(19)3)25(21)14-12-18-9-6-5-7-10-18/h5-7,9-10,15,19H,4,8,11-14,16-17H2,1-3H3/p+1/t19-/m1/s1