5-[[4-(5-chloranylpyridin-2-yl)piperazin-1-ium-1-yl]methyl]-3-thiophen-2-yl-1,2,4-oxadiazole

Systemtic Name: 5-[[4-(5-chloranylpyridin-2-yl)piperazin-1-ium-1-yl]methyl]-3-thiophen-2-yl-1,2,4-oxadiazole Openeye Name: 5-[[4-(5-chloro-2-pyridyl)piperazin-1-ium-1-yl]methyl]-3-(2-thienyl)-1,2,4-oxadiazole CAS Name: 5-[[4-(5-chloro-2-pyridinyl)-1-piperazin-1-iumyl]methyl]-3-thiophen-2-yl-1,2,4-oxadiazole IUPAC Name: 5-[[4-(5-chloropyridin-2-yl)piperazin-1-ium-1-yl]methyl]-3-thiophen-2-yl-1,2,4-oxadiazole Traditional Name: 5-[[4-(5-chloro-2-pyridyl)piperazin-1-ium-1-yl]methyl]-3-(2-thienyl)-1,2,4-oxadiazole Formula: C16H17ClN5OS+ MolecularWeight: 362.85708

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=NC(=NO2)C3=CC=CS3)C4=NC=C(C=C4)Cl

Isomeric SMILES

C1CN(CC[NH+]1CC2=NC(=NO2)C3=CC=CS3)C4=NC=C(C=C4)Cl

InChI

InChI=1S/C16H16ClN5OS/c17-12-3-4-14(18-10-12)22-7-5-21(6-8-22)11-15-19-16(20-23-15)13-2-1-9-24-13/h1-4,9-10H,5-8,11H2/p+1