Cafenstrole

CAS Registry Number®

125306-83-4

CAS Name

Cafenstrole

Molecular Formula

C16H22N4O3S

Molecular Mass

350.44

Cite this Page

Cafenstrole.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=125306-83-4 (retrieved 2024-12-19) (CAS RN: 125306-83-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    115 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C16H22N4O3S/c1-6-19(7-2)16(21)20-10-17-15(18-20)24(22,23)14-12(4)8-11(3)9-13(14)5/h8-10H,6-7H2,1-5H3

InChIKey

InChIKey=HFEJHAAIJZXXRE-UHFFFAOYSA-N

SMILES

S(=O)(=O)(C1=NN(C(N(CC)CC)=O)C=N1)C2=C(C)C=C(C)C=C2C

Canonical SMILES

O=C(N1N=C(N=C1)S(=O)(=O)C=2C(=CC(=CC2C)C)C)N(CC)CC

Other Names for this Substance

  • 1H-1,2,4-Triazole-1-carboxamide, N,N-diethyl-3-[(2,4,6-trimethylphenyl)sulfonyl]-
  • N,N-Diethyl-3-[(2,4,6-trimethylphenyl)sulfonyl]-1H-1,2,4-triazole-1-carboxamide
  • CH 900
  • Cafenstrole
  • Himeadow

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