(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl (2E,4E)-hexa-2,4-dienoate

Systemtic Name: (4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl (2E,4E)-hexa-2,4-dienoate Openeye Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl (2E,4E)-hexa-2,4-dienoate CAS Name: (2E,4E)-hexa-2,4-dienoic acid (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl (2E,4E)-hexa-2,4-dienoate Traditional Name: (2E,4E)-hexa-2,4-dienoic acid (4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester Formula: C13H12N2O3S MolecularWeight: 276.31098

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC=CC(=O)OCC1=NC(=O)C2=C(N1)C=CS2

Isomeric SMILES

C/C=C/C=C/C(=O)OCC1=NC(=O)C2=C(N1)C=CS2

InChI

InChI=1S/C13H12N2O3S/c1-2-3-4-5-11(16)18-8-10-14-9-6-7-19-12(9)13(17)15-10/h2-7H,8H2,1H3,(H,14,15,17)/b3-2+,5-4+