2-[[(1,4,5,6,7,8-Hexahydro-4-oxo[1]benzothieno[2,3-d]pyrimidin-2-yl)methyl]thio]propanoic acid

CAS Registry Number®

743452-17-7
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CAS Name

2-[[(1,4,5,6,7,8-Hexahydro-4-oxo[1]benzothieno[2,3-d]pyrimidin-2-yl)methyl]thio]propanoic acid

Molecular Formula

C14H16N2O3S2

Molecular Mass

324.42

Cite this Page

2-[[(1,4,5,6,7,8-Hexahydro-4-oxo[1]benzothieno[2,3-d]pyrimidin-2-yl)methyl]thio]propanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=743452-17-7 (retrieved 2024-08-20) (CAS RN: 743452-17-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H16N2O3S2/c1-7(14(18)19)20-6-10-15-12(17)11-8-4-2-3-5-9(8)21-13(11)16-10/h7H,2-6H2,1H3,(H,18,19)(H,15,16,17)

InChIKey

InChIKey=MIHKCDODXVZNNR-UHFFFAOYSA-N

SMILES

O=C1C=2C3=C(SC2NC(CSC(C(O)=O)C)=N1)CCCC3

Canonical SMILES

O=C1N=C(NC=2SC3=C(C12)CCCC3)CSC(C(=O)O)C

Other Names for this Substance

  • Propanoic acid, 2-[[(1,4,5,6,7,8-hexahydro-4-oxo[1]benzothieno[2,3-d]pyrimidin-2-yl)methyl]thio]-
  • 2-[[(1,4,5,6,7,8-Hexahydro-4-oxo[1]benzothieno[2,3-d]pyrimidin-2-yl)methyl]thio]propanoic acid