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

Systemtic Name: (5-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl 2-methylsulfonylbenzoate Openeye Name: (5-oxothiazolo[3,2-a]pyrimidin-7-yl)methyl 2-methylsulfonylbenzoate CAS Name: 2-methylsulfonylbenzoic 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 2-methylsulfonylbenzoate Traditional Name: 2-mesylbenzoic acid (5-ketothiazolo[3,2-a]pyrimidin-7-yl)methyl ester Formula: C15H12N2O5S2 MolecularWeight: 364.39618

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)OCC2=CC(=O)N3C=CSC3=N2

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)OCC2=CC(=O)N3C=CSC3=N2

InChI

InChI=1S/C15H12N2O5S2/c1-24(20,21)12-5-3-2-4-11(12)14(19)22-9-10-8-13(18)17-6-7-23-15(17)16-10/h2-8H,9H2,1H3