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

Systemtic Name: (5-bromanylfuran-2-yl)-[4-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (5-bromo-2-furyl)-[4-[[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-4-ium-1-yl]methanone CAS Name: (5-bromo-2-furanyl)-[4-[[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (5-bromofuran-2-yl)-[4-[(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (5-bromo-2-furyl)-[4-[[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl]piperazin-4-ium-1-yl]methanone Formula: C16H16BrN4O3S+ MolecularWeight: 424.29224

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=NC(=NO2)C3=CSC=C3)C(=O)C4=CC=C(O4)Br

Isomeric SMILES

C1CN(CC[NH+]1CC2=NC(=NO2)C3=CSC=C3)C(=O)C4=CC=C(O4)Br

InChI

InChI=1S/C16H15BrN4O3S/c17-13-2-1-12(23-13)16(22)21-6-4-20(5-7-21)9-14-18-15(19-24-14)11-3-8-25-10-11/h1-3,8,10H,4-7,9H2/p+1