Thiophanate

CAS Registry Number®

23564-06-9
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CAS Name

Thiophanate

Molecular Formula

C14H18N4O4S2

Molecular Mass

370.45

Cite this Page

Thiophanate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=23564-06-9 (retrieved 2024-06-27) (CAS RN: 23564-06-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    194 °C (decomp)

Source(s)

  • (1) Hazardous Substances Data Bank data were obtained from the National Library of Medicine (US)

Other Names and Identifiers

InChI

InChI=1S/C14H18N4O4S2/c1-3-21-13(19)17-11(23)15-9-7-5-6-8-10(9)16-12(24)18-14(20)22-4-2/h5-8H,3-4H2,1-2H3,(H2,15,17,19,23)(H2,16,18,20,24)

InChIKey

InChIKey=YFNCATAIYKQPOO-UHFFFAOYSA-N

SMILES

N(C(NC(OCC)=O)=S)C1=C(NC(NC(OCC)=O)=S)C=CC=C1

Canonical SMILES

O=C(OCC)NC(=S)NC=1C=CC=CC1NC(=S)NC(=O)OCC

Other Names for this Substance

  • Carbamic acid, N,N′-[1,2-phenylenebis(iminocarbonothioyl)]bis-, C,C′-diethyl ester
  • Allophanic acid, 4,4′-o-phenylenebis[3-thio-, diethyl ester
  • Carbamic acid, [1,2-phenylenebis(iminocarbonothioyl)]bis-, diethyl ester
  • Thiofanate
  • 1,2-Bis(3-ethoxycarbonyl-2-thioureido)benzene

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Deleted or Replaced CAS Registry Numbers

37233-54-8, 37359-51-6, 39300-54-4