1,5,6,7,8,9-Hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one

CAS Registry Number®

40106-31-8
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CAS Name

1,5,6,7,8,9-Hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one

Molecular Formula

C11H12N2OS

Molecular Mass

220.29

Cite this Page

1,5,6,7,8,9-Hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=40106-31-8 (retrieved 2024-06-16) (CAS RN: 40106-31-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    209-211 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H12N2OS/c14-10-9-7-4-2-1-3-5-8(7)15-11(9)13-6-12-10/h6H,1-5H2,(H,12,13,14)

InChIKey

InChIKey=SMKVVKXYWCYSDN-UHFFFAOYSA-N

SMILES

O=C1C=2C3=C(SC2NC=N1)CCCCC3

Canonical SMILES

O=C1N=CNC=2SC3=C(C12)CCCCC3

Other Names for this Substance

  • 4H-Cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one, 1,5,6,7,8,9-hexahydro-
  • 1,5,6,7,8,9-Hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one

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