(5-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl 4-bromanyl-1H-pyrrole-2-carboxylate

Systemtic Name: (5-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl 4-bromanyl-1H-pyrrole-2-carboxylate Openeye Name: (5-oxothiazolo[3,2-a]pyrimidin-7-yl)methyl 4-bromo-1H-pyrrole-2-carboxylate CAS Name: 4-bromo-1H-pyrrole-2-carboxylic 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 4-bromo-1H-pyrrole-2-carboxylate Traditional Name: 4-bromo-1H-pyrrole-2-carboxylic acid (5-ketothiazolo[3,2-a]pyrimidin-7-yl)methyl ester Formula: C12H8BrN3O3S MolecularWeight: 354.17922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC2=NC(=CC(=O)N21)COC(=O)C3=CC(=CN3)Br

Isomeric SMILES

C1=CSC2=NC(=CC(=O)N21)COC(=O)C3=CC(=CN3)Br

InChI

InChI=1S/C12H8BrN3O3S/c13-7-3-9(14-5-7)11(18)19-6-8-4-10(17)16-1-2-20-12(16)15-8/h1-5,14H,6H2