Methyl 2,3-dihydro-3-(phenylmethyl)-2-thioxo-1H-imidazole-4-carboxylate

CAS Registry Number®

76075-15-5
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CAS Name

Methyl 2,3-dihydro-3-(phenylmethyl)-2-thioxo-1H-imidazole-4-carboxylate

Molecular Formula

C12H12N2O2S

Molecular Mass

248.30

Cite this Page

Methyl 2,3-dihydro-3-(phenylmethyl)-2-thioxo-1H-imidazole-4-carboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=76075-15-5 (retrieved 2024-05-02) (CAS RN: 76075-15-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    174-175 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H12N2O2S/c1-16-11(15)10-7-13-12(17)14(10)8-9-5-3-2-4-6-9/h2-7H,8H2,1H3,(H,13,17)

InChIKey

InChIKey=FWTOEPHWNFXPPZ-UHFFFAOYSA-N

SMILES

C(N1C(C(OC)=O)=CNC1=S)C2=CC=CC=C2

Canonical SMILES

O=C(OC)C1=CNC(=S)N1CC=2C=CC=CC2

Other Names for this Substance

  • 1H-Imidazole-4-carboxylic acid, 2,3-dihydro-3-(phenylmethyl)-2-thioxo-, methyl ester
  • Methyl 2,3-dihydro-3-(phenylmethyl)-2-thioxo-1H-imidazole-4-carboxylate
  • NSC 91544

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