2-([(4-Oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)methyl]thio)propanoic acid, 95%

cas: 743452-17-7 — see every product listed under this CAS number, including other names

2-([(4-Oxo-3,4,5,6,7,8-hexahydro[1]benzothieno[2,3-d]pyrimidin-2-yl)methyl]thio)propanoic acid, 95% (CAS 743452-17-7) is a chemical reagent available from Chemat. Available pack sizes: 5g, 1g, 10g, 250mg, 100mg. Offered by: Combi-blocks.

• 2D
• 3D

2-[(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methylsulfanyl]propanoic acid (CAS 743452-17-7) is a chemical compound with the molecular formula C14H16N2O3S2 and a molecular weight of 324.4 g/mol. IUPAC name: 2-[(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methylsulfanyl]propanoic acid. InChIKey: MIHKCDODXVZNNR-UHFFFAOYSA-N.

Identity

Molecular formula	C14H16N2O3S2
Molecular weight	324.4 g/mol
IUPAC name	2-[(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methylsulfanyl]propanoic acid
InChIKey	MIHKCDODXVZNNR-UHFFFAOYSA-N
SMILES	CC(C(=O)O)SCC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1

Computed by PubChem (NCBI)

Isomers (same molecular formula)

3-[(4-oxo-5,6,7,8-tetrahydro-3H-[1]benzothiolo[2,3-d]pyrimidin-2-yl)methylsulfanyl]propanoic acid C₁₄H₁₆N₂O₃S₂

(4S)-1-benzyl-4-(hydroxymethyl)-5,7-dimethyl-2,3-dithia-5,7-diazabicyclo[2.2.2]octane-6,8-dione C₁₄H₁₆N₂O₃S₂