2-[2-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)ethanoylamino]butanoic acid

Systemtic Name: 2-[2-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)ethanoylamino]butanoic acid Openeye Name: 2-[[2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetyl]amino]butanoic acid CAS Name: 2-[[1-oxo-2-(4-oxo-3-thieno[2,3-d]pyrimidinyl)ethyl]amino]butanoic acid IUPAC Name: 2-[[2-(4-oxothieno[2,3-d]pyrimidin-3-yl)acetyl]amino]butanoic acid Traditional Name: 2-[[2-(4-ketothieno[2,3-d]pyrimidin-3-yl)acetyl]amino]butyric acid Formula: C12H13N3O4S MolecularWeight: 295.31432

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)NC(=O)CN1C=NC2=C(C1=O)C=CS2

Isomeric SMILES

CCC(C(=O)O)NC(=O)CN1C=NC2=C(C1=O)C=CS2

InChI

InChI=1S/C12H13N3O4S/c1-2-8(12(18)19)14-9(16)5-15-6-13-10-7(11(15)17)3-4-20-10/h3-4,6,8H,2,5H2,1H3,(H,14,16)(H,18,19)