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Substance Name: Benzamide, 5-(aminosulfonyl)-2-methoxy-N-(3-(4-phenyl-1-piperazinyl)propyl)-, monomethanesulfonate
RN: 129010-89-5
InChIKey: QTFDGWHKNMOQAV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H28-N4-O4-S.C-H4-O3-S

Molecular Weight

  • 528.6478
 
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Names and Synonyms

Synonym

  • N-(3-(4-Phenyl-1-piperazinyl)propyl)-5-sulfamoyl-2-methoxybenzamide monomethanesulfonate

Systematic Name

  • Benzamide, 5-(aminosulfonyl)-2-methoxy-N-(3-(4-phenyl-1-piperazinyl)propyl)-, monomethanesulfonate

Registry Numbers

CAS Registry Number

  • 129010-89-5

System Generated Number

  • 0129010895

Molecular Formulas

Molecular Formula

  • C21-H28-N4-O4-S.C-H4-O3-S

Molecular Formula Fragments

  • C-H4-O3-S
  • C21-H28-N4-O4-S
  • COMPONENT

Structure Descriptors

InChI

1S/C21H28N4O4S.CH4O3S/c1-29-20-9-8-18(30(22,27)28)16-19(20)21(26)23-10-5-11-24-12-14-25(15-13-24)17-6-3-2-4-7-17;1-5(2,3)4/h2-4,6-9,16H,5,10-15H2,1H3,(H,23,26)(H2,22,27,28);1H3,(H,2,3,4)

InChIKey

QTFDGWHKNMOQAV-UHFFFAOYSA-N

Smiles

COc1ccc(cc1C(=O)NCCCN2CCN(CC2)c3ccccc3)S(=O)(=O)N.CS(=O)(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 153mg/kg (153mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 55, Pg. 797, 1990.