2-[2-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)ethanoylamino]ethyl-di(propan-2-yl)azanium

Systemtic Name: 2-[2-(2-oxidanylidene-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)ethanoylamino]ethyl-di(propan-2-yl)azanium Openeye Name: diisopropyl-[2-[[2-[2-oxo-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]acetyl]amino]ethyl]ammonium CAS Name: 2-[[1-oxo-2-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)ethyl]amino]ethyl-di(propan-2-yl)ammonium IUPAC Name: 2-[[2-(2-oxo-5-thiophen-2-yl-1,3,4-oxadiazol-3-yl)acetyl]amino]ethyl-di(propan-2-yl)azanium Traditional Name: diisopropyl-[2-[[2-[2-keto-5-(2-thienyl)-1,3,4-oxadiazol-3-yl]acetyl]amino]ethyl]ammonium Formula: C16H25N4O3S+ MolecularWeight: 353.4597

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCNC(=O)CN1C(=O)OC(=N1)C2=CC=CS2)C(C)C

Isomeric SMILES

CC(C)[NH+](CCNC(=O)CN1C(=O)OC(=N1)C2=CC=CS2)C(C)C

InChI

InChI=1S/C16H24N4O3S/c1-11(2)19(12(3)4)8-7-17-14(21)10-20-16(22)23-15(18-20)13-6-5-9-24-13/h5-6,9,11-12H,7-8,10H2,1-4H3,(H,17,21)/p+1