3-thieno[2,3-d]pyrimidin-4-ylsulfanylpropanoic acid

Systemtic Name: 3-thieno[2,3-d]pyrimidin-4-ylsulfanylpropanoic acid Openeye Name: 3-thieno[2,3-d]pyrimidin-4-ylsulfanylpropanoic acid CAS Name: 3-(4-thieno[2,3-d]pyrimidinylthio)propanoic acid IUPAC Name: 3-thieno[2,3-d]pyrimidin-4-ylsulfanylpropanoic acid Traditional Name: 3-(thieno[2,3-d]pyrimidin-4-ylthio)propionic acid Formula: C9H8N2O2S2 MolecularWeight: 240.30202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC2=C1C(=NC=N2)SCCC(=O)O

Isomeric SMILES

C1=CSC2=C1C(=NC=N2)SCCC(=O)O

InChI

InChI=1S/C9H8N2O2S2/c12-7(13)2-4-15-9-6-1-3-14-8(6)10-5-11-9/h1,3,5H,2,4H2,(H,12,13)