1,4-Dihydro-6-(methylthio)-4-oxo-2-phenyl-5-pyrimidinecarbonitrile

CAS Registry Number®

15908-64-2
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CAS Name

1,4-Dihydro-6-(methylthio)-4-oxo-2-phenyl-5-pyrimidinecarbonitrile

Molecular Formula

C12H9N3OS

Molecular Mass

243.28

Cite this Page

1,4-Dihydro-6-(methylthio)-4-oxo-2-phenyl-5-pyrimidinecarbonitrile.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=15908-64-2 (retrieved 2024-05-02) (CAS RN: 15908-64-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    341 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H9N3OS/c1-17-12-9(7-13)11(16)14-10(15-12)8-5-3-2-4-6-8/h2-6H,1H3,(H,14,15,16)

InChIKey

InChIKey=OUSBLYHTCSUCNF-UHFFFAOYSA-N

SMILES

S(C)C=1NC(=NC(=O)C1C#N)C2=CC=CC=C2

Canonical SMILES

N#CC=1C(=O)N=C(NC1SC)C=2C=CC=CC2

Other Names for this Substance

  • 5-Pyrimidinecarbonitrile, 1,4-dihydro-6-(methylthio)-4-oxo-2-phenyl-
  • 5-Pyrimidinecarbonitrile, 4-hydroxy-6-(methylthio)-2-phenyl-
  • 1,4-Dihydro-6-(methylthio)-4-oxo-2-phenyl-5-pyrimidinecarbonitrile
  • 4-Methylsulfanyl-6-oxo-2-phenyl-1H-pyrimidine-5-carbonitrile

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