1-[6-(5-Chloro-2,3-dimethoxyphenyl)-3-(methylthio)-1,2,4-triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]ethanone

CAS Registry Number®

430463-84-6
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CAS Name

1-[6-(5-Chloro-2,3-dimethoxyphenyl)-3-(methylthio)-1,2,4-triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]ethanone

Molecular Formula

C21H19ClN4O4S

Molecular Mass

458.92

Cite this Page

1-[6-(5-Chloro-2,3-dimethoxyphenyl)-3-(methylthio)-1,2,4-triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]ethanone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=430463-84-6 (retrieved 2024-09-13) (CAS RN: 430463-84-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H19ClN4O4S/c1-11(27)26-15-8-6-5-7-13(15)17-19(23-21(31-4)25-24-17)30-20(26)14-9-12(22)10-16(28-2)18(14)29-3/h5-10,20H,1-4H3

InChIKey

InChIKey=IXFZMZLSYOTQQQ-UHFFFAOYSA-N

SMILES

C(C)(=O)N1C(OC=2C(C=3C1=CC=CC3)=NN=C(SC)N2)C4=C(OC)C(OC)=CC(Cl)=C4

Canonical SMILES

O=C(N1C2=CC=CC=C2C=3N=NC(=NC3OC1C=4C=C(Cl)C=C(OC)C4OC)SC)C

Other Names for this Substance

  • Ethanone, 1-[6-(5-chloro-2,3-dimethoxyphenyl)-3-(methylthio)-1,2,4-triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]-
  • 1,2,4-Triazino[5,6-d][3,1]benzoxazepine, 7-acetyl-6-(5-chloro-2,3-dimethoxyphenyl)-6,7-dihydro-3-(methylthio)-
  • 1-[6-(5-Chloro-2,3-dimethoxyphenyl)-3-(methylthio)-1,2,4-triazino[5,6-d][3,1]benzoxazepin-7(6H)-yl]ethanone