(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate

Systemtic Name: (4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Openeye Name: (4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate CAS Name: (3S)-2,3-dihydro-1,4-benzodioxin-3-carboxylic 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 (3S)-2,3-dihydro-1,4-benzodioxine-3-carboxylate Traditional Name: (3S)-2,3-dihydro-1,4-benzodioxin-3-carboxylic acid (4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl ester Formula: C16H12N2O5S MolecularWeight: 344.34188

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC2=CC=CC=C2O1)C(=O)OCC3=NC(=O)C4=C(N3)C=CS4

Isomeric SMILES

C1[C@H](OC2=CC=CC=C2O1)C(=O)OCC3=NC(=O)C4=C(N3)C=CS4

InChI

InChI=1S/C16H12N2O5S/c19-15-14-9(5-6-24-14)17-13(18-15)8-22-16(20)12-7-21-10-3-1-2-4-11(10)23-12/h1-6,12H,7-8H2,(H,17,18,19)/t12-/m0/s1