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

Systemtic Name: 4-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-4-ium-2-one Openeye Name: 4-[[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-4-ium-2-one CAS Name: 4-[[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]methyl]-2-piperazin-4-iumone IUPAC Name: 4-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-4-ium-2-one Traditional Name: 4-[[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-4-ium-2-one Formula: C11H13N4O2S+ MolecularWeight: 265.31152

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC(=O)N1)CC2=NC(=NO2)C3=CSC=C3

Isomeric SMILES

C1C[NH+](CC(=O)N1)CC2=NC(=NO2)C3=CSC=C3

InChI

InChI=1S/C11H12N4O2S/c16-9-5-15(3-2-12-9)6-10-13-11(14-17-10)8-1-4-18-7-8/h1,4,7H,2-3,5-6H2,(H,12,16)/p+1