7-methyl-2-(3-oxidanylidenepiperazin-1-ium-1-ylidene)-3H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one

Systemtic Name: 7-methyl-2-(3-oxidanylidenepiperazin-1-ium-1-ylidene)-3H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one Openeye Name: 7-methyl-2-(3-oxopiperazin-1-ium-1-ylidene)-3H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one CAS Name: 7-methyl-2-(3-oxo-1-piperazin-1-iumylidene)-3H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one IUPAC Name: 7-methyl-2-(3-oxopiperazin-1-ium-1-ylidene)-3H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one Traditional Name: 2-(3-ketopiperazin-1-ium-1-ylidene)-7-methyl-3H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one Formula: C10H12N5O2S+ MolecularWeight: 266.29958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)N2C(=N1)SC(=[N+]3CCNC(=O)C3)N2

Isomeric SMILES

CC1=CC(=O)N2C(=N1)SC(=[N+]3CCNC(=O)C3)N2

InChI

InChI=1S/C10H11N5O2S/c1-6-4-8(17)15-9(12-6)18-10(13-15)14-3-2-11-7(16)5-14/h4H,2-3,5H2,1H3,(H,11,16)/p+1