6-methyl-7-oxidanyl-8-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-8-ium-5-one

Systemtic Name: 6-methyl-7-oxidanyl-8-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-8-ium-5-one Openeye Name: 7-hydroxy-6-methyl-8-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-8-ium-5-one CAS Name: 7-hydroxy-6-methyl-8-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-8-ium-5-one IUPAC Name: 7-hydroxy-6-methyl-8-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-8-ium-5-one Traditional Name: 7-hydroxy-6-methyl-8-propyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-8-ium-5-one Formula: C9H12N3O2S+ MolecularWeight: 226.27548

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Descriptors Computed from Structure

Canonical SMILES:

CCC[N+]1=C2N(C(=O)C(=C1O)C)N=CS2

Isomeric SMILES

CCC[N+]1=C2N(C(=O)C(=C1O)C)N=CS2

InChI

InChI=1S/C9H11N3O2S/c1-3-4-11-7(13)6(2)8(14)12-9(11)15-5-10-12/h5H,3-4H2,1-2H3/p+1