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

Systemtic Name: 6-methyl-7-oxidanyl-8-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-8-ium-5-one Openeye Name: 7-hydroxy-6-methyl-8-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-8-ium-5-one CAS Name: 7-hydroxy-6-methyl-8-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-8-ium-5-one IUPAC Name: 7-hydroxy-6-methyl-8-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-8-ium-5-one Traditional Name: 7-hydroxy-6-methyl-8-phenyl-[1,3,4]thiadiazolo[3,2-a]pyrimidin-8-ium-5-one Formula: C12H10N3O2S+ MolecularWeight: 260.2917

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C([N+](=C2N(C1=O)N=CS2)C3=CC=CC=C3)O

Isomeric SMILES

CC1=C([N+](=C2N(C1=O)N=CS2)C3=CC=CC=C3)O

InChI

InChI=1S/C12H9N3O2S/c1-8-10(16)14(9-5-3-2-4-6-9)12-15(11(8)17)13-7-18-12/h2-7H,1H3/p+1