Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Benzamide, 4-amino-N-((1-ethyl-2-pyrrolidinyl)methyl)-5-(ethylsulfonyl)-2-methoxy-, (-)-, (S-(R*,R*))-2,3-dihydroxybutanedioate (1:1)
RN: 72005-57-3
InChIKey: TZPHEDZMFSJFOE-RBTVCSKBSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H27-N3-O4-S.C4-H6-O6

Molecular Weight

  • 519.5687
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonym

  • l-N-((1-Ethyl-2-pyrrolidinyl)methyl)-2-methoxy-4-amino-5-ethylsulphonylbenzamide tartrate

Systematic Name

  • Benzamide, 4-amino-N-((1-ethyl-2-pyrrolidinyl)methyl)-5-(ethylsulfonyl)-2-methoxy-, (-)-, (S-(R*,R*))-2,3-dihydroxybutanedioate (1:1)

Registry Numbers

CAS Registry Number

  • 72005-57-3

System Generated Number

  • 0072005573

Molecular Formulas

Molecular Formula

  • C17-H27-N3-O4-S.C4-H6-O6

Molecular Formula Fragments

  • C17-H27-N3-O4-S
  • C4-H6-O6
  • COMPONENT

Structure Descriptors

InChI

1S/C17H27N3O4S.C4H6O6/c1-4-20-8-6-7-12(20)11-19-17(21)13-9-16(25(22,23)5-2)14(18)10-15(13)24-3;5-1(3(7)8)2(6)4(9)10/h9-10,12H,4-8,11,18H2,1-3H3,(H,19,21);1-2,5-6H,(H,7,8)(H,9,10)/t12-;1-,2-/m00/s1

InChIKey

TZPHEDZMFSJFOE-RBTVCSKBSA-N

Smiles

CCN1CCC[C@H]1CNC(=O)c2cc(c(cc2OC)N)S(=O)(=O)CC.[C@H]([C@@H](C(=O)O)O)(C(=O)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 122mg/kg (122mg/kg)   United States Patent Document. Vol. #4401822,
mouse LD50 intravenous 44800ug/kg (44.8mg/kg)   United States Patent Document. Vol. #4401822,
mouse LD50 oral 1109mg/kg (1109mg/kg)   United States Patent Document. Vol. #4401822,
mouse LD50 subcutaneous 137mg/kg (137mg/kg)   United States Patent Document. Vol. #4401822,