[2-(2-methyl-5-oxidanylidene-4-propyl-oxolan-2-yl)-2-oxidanylidene-ethyl]-(1,3,4-thiadiazol-2-yl)azanium bromide

Systemtic Name: [2-(2-methyl-5-oxidanylidene-4-propyl-oxolan-2-yl)-2-oxidanylidene-ethyl]-(1,3,4-thiadiazol-2-yl)azanium bromide Openeye Name: [2-(2-methyl-5-oxo-4-propyl-tetrahydrofuran-2-yl)-2-oxo-ethyl]-(1,3,4-thiadiazol-2-yl)ammonium bromide CAS Name: [2-(2-methyl-5-oxo-4-propyl-2-oxolanyl)-2-oxoethyl]-(1,3,4-thiadiazol-2-yl)ammonium bromide IUPAC Name: [2-(2-methyl-5-oxo-4-propyloxolan-2-yl)-2-oxoethyl]-(1,3,4-thiadiazol-2-yl)azanium bromide Traditional Name: [2-keto-2-(5-keto-2-methyl-4-propyl-tetrahydrofuran-2-yl)ethyl]-(1,3,4-thiadiazol-2-yl)ammonium bromide Formula: C12H18BrN3O3S MolecularWeight: 364.25862

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CC(OC1=O)(C)C(=O)C[NH2+]C2=NN=CS2.[Br-]

Isomeric SMILES

CCCC1CC(OC1=O)(C)C(=O)C[NH2+]C2=NN=CS2.[Br-]

InChI

InChI=1S/C12H17N3O3S.BrH/c1-3-4-8-5-12(2,18-10(8)17)9(16)6-13-11-15-14-7-19-11;/h7-8H,3-6H2,1-2H3,(H,13,15);1H