4-[[4-[2,5-bis(bromanyl)phenyl]sulfonylpiperazin-1-ium-1-yl]methyl]-2-methyl-1,3-thiazole

Systemtic Name: 4-[[4-[2,5-bis(bromanyl)phenyl]sulfonylpiperazin-1-ium-1-yl]methyl]-2-methyl-1,3-thiazole Openeye Name: 4-[[4-(2,5-dibromophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-methyl-thiazole CAS Name: 4-[[4-(2,5-dibromophenyl)sulfonyl-1-piperazin-1-iumyl]methyl]-2-methylthiazole IUPAC Name: 4-[[4-(2,5-dibromophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-methyl-1,3-thiazole Traditional Name: 4-[[4-(2,5-dibromophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-2-methyl-thiazole Formula: C15H18Br2N3O2S2+ MolecularWeight: 496.26032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)C[NH+]2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)Br)Br

Isomeric SMILES

CC1=NC(=CS1)C[NH+]2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)Br)Br

InChI

InChI=1S/C15H17Br2N3O2S2/c1-11-18-13(10-23-11)9-19-4-6-20(7-5-19)24(21,22)15-8-12(16)2-3-14(15)17/h2-3,8,10H,4-7,9H2,1H3/p+1