6-Chloro-8-[[(4-methyl-4H-1,2,4-triazol-3-yl)thio]methyl]-4-oxo-4H-1-benzopyran-3-carboxaldehyde

CAS Registry Number®

730992-67-3
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CAS Name

6-Chloro-8-[[(4-methyl-4H-1,2,4-triazol-3-yl)thio]methyl]-4-oxo-4H-1-benzopyran-3-carboxaldehyde

Molecular Formula

C14H10ClN3O3S

Molecular Mass

335.77

Cite this Page

6-Chloro-8-[[(4-methyl-4H-1,2,4-triazol-3-yl)thio]methyl]-4-oxo-4H-1-benzopyran-3-carboxaldehyde.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=730992-67-3 (retrieved 2024-09-07) (CAS RN: 730992-67-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C14H10ClN3O3S/c1-18-7-16-17-14(18)22-6-8-2-10(15)3-11-12(20)9(4-19)5-21-13(8)11/h2-5,7H,6H2,1H3

InChIKey

InChIKey=PUCIWBGMYCZVJZ-UHFFFAOYSA-N

SMILES

O=C1C=2C(=C(CSC=3N(C)C=NN3)C=C(Cl)C2)OC=C1C=O

Canonical SMILES

O=CC1=COC=2C(=CC(Cl)=CC2CSC3=NN=CN3C)C1=O

Other Names for this Substance

  • 4H-1-Benzopyran-3-carboxaldehyde, 6-chloro-8-[[(4-methyl-4H-1,2,4-triazol-3-yl)thio]methyl]-4-oxo-
  • 6-Chloro-8-[[(4-methyl-4H-1,2,4-triazol-3-yl)thio]methyl]-4-oxo-4H-1-benzopyran-3-carboxaldehyde