1,4,5,6,7,8-Hexahydro-4-oxo[1]benzothieno[2,3-d]pyrimidine-2-propanoic acid

CAS Registry Number®

109164-47-8
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CAS Name

1,4,5,6,7,8-Hexahydro-4-oxo[1]benzothieno[2,3-d]pyrimidine-2-propanoic acid

Molecular Formula

C13H14N2O3S

Molecular Mass

278.33

Cite this Page

1,4,5,6,7,8-Hexahydro-4-oxo[1]benzothieno[2,3-d]pyrimidine-2-propanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=109164-47-8 (retrieved 2024-04-27) (CAS RN: 109164-47-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H14N2O3S/c16-10(17)6-5-9-14-12(18)11-7-3-1-2-4-8(7)19-13(11)15-9/h1-6H2,(H,16,17)(H,14,15,18)

InChIKey

InChIKey=ZUYIZUTYDFCUMM-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • [1]Benzothieno[2,3-d]pyrimidine-2-propanoic acid, 1,4,5,6,7,8-hexahydro-4-oxo-
  • 1,4,5,6,7,8-Hexahydro-4-oxo[1]benzothieno[2,3-d]pyrimidine-2-propanoic acid

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