2-bromanyl-6-ethyl-7-methyl-8H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-4-ium-5-one

Systemtic Name: 2-bromanyl-6-ethyl-7-methyl-8H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-4-ium-5-one Openeye Name: 2-bromo-6-ethyl-7-methyl-8H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-4-ium-5-one CAS Name: 2-bromo-6-ethyl-7-methyl-8H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-4-ium-5-one IUPAC Name: 2-bromo-6-ethyl-7-methyl-8H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-4-ium-5-one Traditional Name: 2-bromo-6-ethyl-7-methyl-8H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-4-ium-5-one Formula: C8H9BrN3OS+ MolecularWeight: 275.14556

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC2=[N+](C1=O)N=C(S2)Br)C

Isomeric SMILES

CCC1=C(NC2=[N+](C1=O)N=C(S2)Br)C

InChI

InChI=1S/C8H8BrN3OS/c1-3-5-4(2)10-8-12(6(5)13)11-7(9)14-8/h3H2,1-2H3/p+1