1-(1H-indol-3-yl)-2-[[5-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone

Systemtic Name: 1-(1H-indol-3-yl)-2-[[5-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone Openeye Name: 1-(1H-indol-3-yl)-2-[[5-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone CAS Name: 1-(1H-indol-3-yl)-2-[[5-(1-pyrrolidin-1-iumylmethyl)-1,3,4-oxadiazol-2-yl]thio]ethanone IUPAC Name: 1-(1H-indol-3-yl)-2-[[5-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-oxadiazol-2-yl]sulfanyl]ethanone Traditional Name: 1-(1H-indol-3-yl)-2-[[5-(pyrrolidin-1-ium-1-ylmethyl)-1,3,4-oxadiazol-2-yl]thio]ethanone Formula: C17H19N4O2S+ MolecularWeight: 343.42336

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=NN=C(O2)SCC(=O)C3=CNC4=CC=CC=C43

Isomeric SMILES

C1CC[NH+](C1)CC2=NN=C(O2)SCC(=O)C3=CNC4=CC=CC=C43

InChI

InChI=1S/C17H18N4O2S/c22-15(13-9-18-14-6-2-1-5-12(13)14)11-24-17-20-19-16(23-17)10-21-7-3-4-8-21/h1-2,5-6,9,18H,3-4,7-8,10-11H2/p+1