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

Systemtic Name: 2-(2,5-dimethylfuran-3-yl)-5-[(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]-1,3,4-oxadiazole Openeye Name: 2-(2,5-dimethyl-3-furyl)-5-[[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]methyl]-1,3,4-oxadiazole CAS Name: 2-(2,5-dimethyl-3-furanyl)-5-[(4-thiophen-2-ylsulfonyl-1-piperazin-1-iumyl)methyl]-1,3,4-oxadiazole IUPAC Name: 2-(2,5-dimethylfuran-3-yl)-5-[(4-thiophen-2-ylsulfonylpiperazin-1-ium-1-yl)methyl]-1,3,4-oxadiazole Traditional Name: 2-(2,5-dimethyl-3-furyl)-5-[[4-(2-thienylsulfonyl)piperazin-1-ium-1-yl]methyl]-1,3,4-oxadiazole Formula: C17H21N4O4S2+ MolecularWeight: 409.50304

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C2=NN=C(O2)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

CC1=CC(=C(O1)C)C2=NN=C(O2)C[NH+]3CCN(CC3)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C17H20N4O4S2/c1-12-10-14(13(2)24-12)17-19-18-15(25-17)11-20-5-7-21(8-6-20)27(22,23)16-4-3-9-26-16/h3-4,9-10H,5-8,11H2,1-2H3/p+1