3-(4-Ethoxyphenyl)-2,3,5,6,7,8-hexahydro-2-thioxo[1]benzothieno[2,3-d]pyrimidin-4(1H)-one

CAS Registry Number®

65234-03-9
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CAS Name

3-(4-Ethoxyphenyl)-2,3,5,6,7,8-hexahydro-2-thioxo[1]benzothieno[2,3-d]pyrimidin-4(1H)-one

Molecular Formula

C18H18N2O2S2

Molecular Mass

358.48

Cite this Page

3-(4-Ethoxyphenyl)-2,3,5,6,7,8-hexahydro-2-thioxo[1]benzothieno[2,3-d]pyrimidin-4(1H)-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=65234-03-9 (retrieved 2024-04-28) (CAS RN: 65234-03-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    288-290 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C18H18N2O2S2/c1-2-22-12-9-7-11(8-10-12)20-17(21)15-13-5-3-4-6-14(13)24-16(15)19-18(20)23/h7-10H,2-6H2,1H3,(H,19,23)

InChIKey

InChIKey=TVVBAUVSQIVFLE-UHFFFAOYSA-N

SMILES

O=C1C=2C3=C(SC2NC(=S)N1C4=CC=C(OCC)C=C4)CCCC3

Canonical SMILES

O=C1C2=C(SC3=C2CCCC3)NC(=S)N1C4=CC=C(OCC)C=C4

Other Names for this Substance

  • [1]Benzothieno[2,3-d]pyrimidin-4(1H)-one, 3-(4-ethoxyphenyl)-2,3,5,6,7,8-hexahydro-2-thioxo-
  • 3-(4-Ethoxyphenyl)-2,3,5,6,7,8-hexahydro-2-thioxo[1]benzothieno[2,3-d]pyrimidin-4(1H)-one

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