(5-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl 5-bromanylpyridine-3-carboxylate

Systemtic Name: (5-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl 5-bromanylpyridine-3-carboxylate Openeye Name: (5-oxothiazolo[3,2-a]pyrimidin-7-yl)methyl 5-bromopyridine-3-carboxylate CAS Name: 5-bromo-3-pyridinecarboxylic acid (5-oxo-7-thiazolo[3,2-a]pyrimidinyl)methyl ester IUPAC Name: (5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl 5-bromopyridine-3-carboxylate Traditional Name: 5-bromonicotinic acid (5-ketothiazolo[3,2-a]pyrimidin-7-yl)methyl ester Formula: C13H8BrN3O3S MolecularWeight: 366.18992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC2=NC(=CC(=O)N21)COC(=O)C3=CC(=CN=C3)Br

Isomeric SMILES

C1=CSC2=NC(=CC(=O)N21)COC(=O)C3=CC(=CN=C3)Br

InChI

InChI=1S/C13H8BrN3O3S/c14-9-3-8(5-15-6-9)12(19)20-7-10-4-11(18)17-1-2-21-13(17)16-10/h1-6H,7H2