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Substance Name: Ethanone, 2-(4-(3-chlorophenyl)-1-piperazinyl)-1-(4-(methylsulfonyl)phenyl)-
RN: 56621-58-0
InChIKey: QOAXRBDBTCODTE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H21-Cl-N2-O3-S

Molecular Weight

  • 392.905
 
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Names and Synonyms

Synonyms

  • 2-(4-(3-Chlorophenyl)-1-piperazinyl)-1-(4-(methylsulfonyl)phenyl)ethanone
  • 5-23-02-00241 (Beilstein Handbook Reference)
  • BRN 0898882

Systematic Name

  • Ethanone, 2-(4-(3-chlorophenyl)-1-piperazinyl)-1-(4-(methylsulfonyl)phenyl)-

Registry Numbers

CAS Registry Number

  • 56621-58-0

System Generated Number

  • 0056621580

Structure Descriptors

InChI

1S/C19H21ClN2O3S/c1-26(24,25)18-7-5-15(6-8-18)19(23)14-21-9-11-22(12-10-21)17-4-2-3-16(20)13-17/h2-8,13H,9-12,14H2,1H3

InChIKey

QOAXRBDBTCODTE-UHFFFAOYSA-N

Smiles

c1(N2CCN(CC(c3ccc(S(C)(=O)=O)cc3)=O)CC2)cc(ccc1)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1gm/kg (1000mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 40, Pg. 1204, 1975.