1,3-bis(phenylmethyl)-2-thiophen-2-yl-4,5-dihydroimidazol-1-ium bromide

Systemtic Name: 1,3-bis(phenylmethyl)-2-thiophen-2-yl-4,5-dihydroimidazol-1-ium bromide Openeye Name: 1,3-dibenzyl-2-(2-thienyl)-4,5-dihydroimidazol-1-ium bromide CAS Name: 1,3-bis(phenylmethyl)-2-thiophen-2-yl-4,5-dihydroimidazol-1-ium bromide IUPAC Name: 1,3-dibenzyl-2-thiophen-2-yl-4,5-dihydroimidazol-1-ium bromide Traditional Name: 1,3-dibenzyl-2-(2-thienyl)-2-imidazolin-1-ium bromide Formula: C21H21BrN2S MolecularWeight: 413.37384

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+](=C(N1CC2=CC=CC=C2)C3=CC=CS3)CC4=CC=CC=C4.[Br-]

Isomeric SMILES

C1C[N+](=C(N1CC2=CC=CC=C2)C3=CC=CS3)CC4=CC=CC=C4.[Br-]

InChI

InChI=1S/C21H21N2S.BrH/c1-3-8-18(9-4-1)16-22-13-14-23(17-19-10-5-2-6-11-19)21(22)20-12-7-15-24-20;/h1-12,15H,13-14,16-17H2;1H/q+1;/p-1