1-[5-Bromo-2-methyl-4-(methylsulfonyl)phenyl]hexahydro-1H-1,4-diazepine

CAS Registry Number®

1020722-24-0
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CAS Name

1-[5-Bromo-2-methyl-4-(methylsulfonyl)phenyl]hexahydro-1H-1,4-diazepine

Molecular Formula

C13H19BrN2O2S

Molecular Mass

347.27

Cite this Page

1-[5-Bromo-2-methyl-4-(methylsulfonyl)phenyl]hexahydro-1H-1,4-diazepine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1020722-24-0 (retrieved 2024-08-21) (CAS RN: 1020722-24-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C13H19BrN2O2S/c1-10-8-13(19(2,17)18)11(14)9-12(10)16-6-3-4-15-5-7-16/h8-9,15H,3-7H2,1-2H3

InChIKey

InChIKey=IGYSNLMZXSZNPQ-UHFFFAOYSA-N

SMILES

CC1=C(C=C(Br)C(S(C)(=O)=O)=C1)N2CCCNCC2

Canonical SMILES

O=S(=O)(C=1C=C(C(=CC1Br)N2CCNCCC2)C)C

Other Names for this Substance

  • 1H-1,4-Diazepine, 1-[5-bromo-2-methyl-4-(methylsulfonyl)phenyl]hexahydro-
  • 1-[5-Bromo-2-methyl-4-(methylsulfonyl)phenyl]hexahydro-1H-1,4-diazepine