methyl 5-oxidanylidene-3-phenyl-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-7-carboxylate

Systemtic Name: methyl 5-oxidanylidene-3-phenyl-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-7-carboxylate Openeye Name: methyl 5-oxo-3-phenyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-7-carboxylate CAS Name: 5-oxo-3-phenyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-7-carboxylic acid methyl ester IUPAC Name: methyl 5-oxo-3-phenyl-8H-[1,3]thiazolo[3,2-a]pyrimidin-4-ium-7-carboxylate Traditional Name: 5-keto-3-phenyl-8H-thiazolo[3,2-a]pyrimidin-4-ium-7-carboxylic acid methyl ester Formula: C14H11N2O3S+ MolecularWeight: 287.31374

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=O)[N+]2=C(N1)SC=C2C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CC(=O)[N+]2=C(N1)SC=C2C3=CC=CC=C3

InChI

InChI=1S/C14H10N2O3S/c1-19-13(18)10-7-12(17)16-11(8-20-14(16)15-10)9-5-3-2-4-6-9/h2-8H,1H3/p+1