bis[(5-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl] pyridine-2,6-dicarboxylate

Systemtic Name: bis[(5-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl] pyridine-2,6-dicarboxylate Openeye Name: bis[(5-oxothiazolo[3,2-a]pyrimidin-7-yl)methyl] pyridine-2,6-dicarboxylate CAS Name: pyridine-2,6-dicarboxylic acid bis[(5-oxo-7-thiazolo[3,2-a]pyrimidinyl)methyl] ester IUPAC Name: bis[(5-oxo-[1,3]thiazolo[3,2-a]pyrimidin-7-yl)methyl] pyridine-2,6-dicarboxylate Traditional Name: pyridine-2,6-dicarboxylic acid bis[(5-ketothiazolo[3,2-a]pyrimidin-7-yl)methyl] ester Formula: C21H13N5O6S2 MolecularWeight: 495.48782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC(=C1)C(=O)OCC2=CC(=O)N3C=CSC3=N2)C(=O)OCC4=CC(=O)N5C=CSC5=N4

Isomeric SMILES

C1=CC(=NC(=C1)C(=O)OCC2=CC(=O)N3C=CSC3=N2)C(=O)OCC4=CC(=O)N5C=CSC5=N4

InChI

InChI=1S/C21H13N5O6S2/c27-16-8-12(22-20-25(16)4-6-33-20)10-31-18(29)14-2-1-3-15(24-14)19(30)32-11-13-9-17(28)26-5-7-34-21(26)23-13/h1-9H,10-11H2