5,5-bis(oxidanylidene)-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-3-ium-2-amine bromide

Systemtic Name: 5,5-bis(oxidanylidene)-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-3-ium-2-amine bromide Openeye Name: 5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d]thiazol-3-ium-2-amine bromide CAS Name: 5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d]thiazol-3-ium-2-amine bromide IUPAC Name: 5,5-dioxo-3a,4,6,6a-tetrahydrothieno[3,4-d][1,3]thiazol-3-ium-2-amine bromide Traditional Name: (5,5-diketo-3a,4,6,6a-tetrahydrothieno[3,4-d]thiazol-3-ium-2-yl)amine bromide Formula: C5H9BrN2O2S2 MolecularWeight: 273.17116

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Descriptors Computed from Structure

Canonical SMILES:

C1C2C(CS1(=O)=O)SC(=[NH+]2)N.[Br-]

Isomeric SMILES

C1C2C(CS1(=O)=O)SC(=[NH+]2)N.[Br-]

InChI

InChI=1S/C5H8N2O2S2.BrH/c6-5-7-3-1-11(8,9)2-4(3)10-5;/h3-4H,1-2H2,(H2,6,7);1H