3-[[4-(4-bromanyl-2-chloranyl-phenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-1,3-oxazolidine-2-thione

Systemtic Name: 3-[[4-(4-bromanyl-2-chloranyl-phenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-1,3-oxazolidine-2-thione Openeye Name: 3-[[4-(4-bromo-2-chloro-phenyl)sulfonylpiperazin-1-ium-1-yl]methyl]oxazolidine-2-thione CAS Name: 3-[[4-(4-bromo-2-chlorophenyl)sulfonyl-1-piperazin-1-iumyl]methyl]-2-oxazolidinethione IUPAC Name: 3-[[4-(4-bromo-2-chlorophenyl)sulfonylpiperazin-1-ium-1-yl]methyl]-1,3-oxazolidine-2-thione Traditional Name: 3-[[4-(4-bromo-2-chloro-phenyl)sulfonylpiperazin-1-ium-1-yl]methyl]oxazolidine-2-thione Formula: C14H18BrClN3O3S2+ MolecularWeight: 455.79802

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CN2CCOC2=S)S(=O)(=O)C3=C(C=C(C=C3)Br)Cl

Isomeric SMILES

C1CN(CC[NH+]1CN2CCOC2=S)S(=O)(=O)C3=C(C=C(C=C3)Br)Cl

InChI

InChI=1S/C14H17BrClN3O3S2/c15-11-1-2-13(12(16)9-11)24(20,21)19-5-3-17(4-6-19)10-18-7-8-22-14(18)23/h1-2,9H,3-8,10H2/p+1