1-[3-(4-nitrophenyl)-5,6-dihydroimidazo[2,1-b]thiazol-7-ium-7-yl]ethanone

Properties Image MNX_ID MNXM340939 reference chebi:103879 formula C13H12N3O3S global charge 1 mol weight 290.324 InChIKey ICMZPORYJMYECY-UHFFFAOYSA-N InChI InChI=1S/C13H12N3O3S/c1-9(17)14-6-7-15-12(8-20-13(14)15)10-2-4-11(5-3-10)16(18)19/h2-5,8H,6-7H2,1H3/q+1 SMILES CC(=O)[N+]1=C2SC=C(C3=CC=C([N+](=O)[O-])C=C3)N2CC1 MNX internals InChI (mnx) InChI=1/C13H12N3O3S/c1-9(17)14-6-7-15-12(8-20-13(14)15)10-2-4-11(5-3-10)16(18)19/h2-5,8H,6-7H2,1H3/q+1 SMILES (mnx) [CH3:1][C:9]([N+:14]1=[C:13]2[N:15]([CH2:7][CH2:6]1)[C:12]([C:10]1=[CH:3][CH:5]=[C:11]([N+:16]([O-:18])=[O:19])[CH:4]=[CH:2]1)=[CH:8][S:20]2)=[O:17]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0