4-[[4-(5-bromanylpyridin-2-yl)piperazin-1-ium-1-yl]methyl]-5-chloranyl-1,2,3-thiadiazole

Systemtic Name: 4-[[4-(5-bromanylpyridin-2-yl)piperazin-1-ium-1-yl]methyl]-5-chloranyl-1,2,3-thiadiazole Openeye Name: 4-[[4-(5-bromo-2-pyridyl)piperazin-1-ium-1-yl]methyl]-5-chloro-thiadiazole CAS Name: 4-[[4-(5-bromo-2-pyridinyl)-1-piperazin-1-iumyl]methyl]-5-chlorothiadiazole IUPAC Name: 4-[[4-(5-bromopyridin-2-yl)piperazin-1-ium-1-yl]methyl]-5-chlorothiadiazole Traditional Name: 4-[[4-(5-bromo-2-pyridyl)piperazin-1-ium-1-yl]methyl]-5-chloro-thiadiazole Formula: C12H14BrClN5S+ MolecularWeight: 375.69506

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C(SN=N2)Cl)C3=NC=C(C=C3)Br

Isomeric SMILES

C1CN(CC[NH+]1CC2=C(SN=N2)Cl)C3=NC=C(C=C3)Br

InChI

InChI=1S/C12H13BrClN5S/c13-9-1-2-11(15-7-9)19-5-3-18(4-6-19)8-10-12(14)20-17-16-10/h1-2,7H,3-6,8H2/p+1