2-[[4-(3-bromophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]imidazo[1,2-a]pyridine

Systemtic Name: 2-[[4-(3-bromophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]imidazo[1,2-a]pyridine Openeye Name: 2-[[4-(3-bromophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]imidazo[1,2-a]pyridine CAS Name: 2-[[4-(3-bromophenyl)sulfonyl-1-piperazin-1-iumyl]methyl]imidazo[1,2-a]pyridine IUPAC Name: 2-[[4-(3-bromophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]imidazo[1,2-a]pyridine Traditional Name: 2-[[4-(3-bromophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]imidazo[1,2-a]pyridine Formula: C18H20BrN4O2S+ MolecularWeight: 436.346

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CN3C=CC=CC3=N2)S(=O)(=O)C4=CC(=CC=C4)Br

Isomeric SMILES

C1CN(CC[NH+]1CC2=CN3C=CC=CC3=N2)S(=O)(=O)C4=CC(=CC=C4)Br

InChI

InChI=1S/C18H19BrN4O2S/c19-15-4-3-5-17(12-15)26(24,25)23-10-8-21(9-11-23)13-16-14-22-7-2-1-6-18(22)20-16/h1-7,12,14H,8-11,13H2/p+1