2-[[4-(4-bromanyl-3-methyl-phenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-8-methyl-imidazo[1,2-a]pyridine

Systemtic Name: 2-[[4-(4-bromanyl-3-methyl-phenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-8-methyl-imidazo[1,2-a]pyridine Openeye Name: 2-[[4-(4-bromo-3-methyl-phenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-8-methyl-imidazo[1,2-a]pyridine CAS Name: 2-[[4-(4-bromo-3-methylphenyl)sulfonyl-1-piperazin-1-iumyl]methyl]-8-methylimidazo[1,2-a]pyridine IUPAC Name: 2-[[4-(4-bromo-3-methylphenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-8-methylimidazo[1,2-a]pyridine Traditional Name: 2-[[4-(4-bromo-3-methyl-phenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-8-methyl-imidazo[1,2-a]pyridine Formula: C20H24BrN4O2S+ MolecularWeight: 464.39916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CN2C1=NC(=C2)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)Br)C

Isomeric SMILES

CC1=CC=CN2C1=NC(=C2)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC(=C(C=C4)Br)C

InChI

InChI=1S/C20H23BrN4O2S/c1-15-4-3-7-24-14-17(22-20(15)24)13-23-8-10-25(11-9-23)28(26,27)18-5-6-19(21)16(2)12-18/h3-7,12,14H,8-11,13H2,1-2H3/p+1