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Substance Name: Acetamide, 2-(4-methyl-1-piperazinyl)-N-(2-(phenylmethyl)phenyl)-, (Z)-2-butenedioate (1:2)
RN: 118989-86-9
InChIKey: WEUDOTCXYMPVAS-LVEZLNDCSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H25-N3-O.2C4-H4-O4

Molecular Weight

  • 555.5807
 
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Names and Synonyms

Synonyms

  • 1-Piperazineacetamide, 4-methyl-N-(2-(phenylmethyl)phenyl)-, (Z)-2-butenedioate (1:2)
  • N-(2-Benzylphenyl)-2-(4-methyl-1-piperazinyl)acetamide bis(hydrogen maleate)

Systematic Name

  • Acetamide, 2-(4-methyl-1-piperazinyl)-N-(2-(phenylmethyl)phenyl)-, (Z)-2-butenedioate (1:2)

Registry Numbers

CAS Registry Number

  • 118989-86-9

System Generated Number

  • 0118989869

Molecular Formulas

Molecular Formula

  • C20-H25-N3-O.2C4-H4-O4

Molecular Formula Fragments

  • C20-H25-N3-O
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C20H25N3O.2C4H4O4/c1-16-14-22(15-20(21)24)11-12-23(16)19-10-6-5-9-18(19)13-17-7-3-2-4-8-17;2*5-3(6)1-2-4(7)8/h2-10,16H,11-15H2,1H3,(H2,21,24);2*1-2H,(H,5,6)(H,7,8)/b;2*2-1+

InChIKey

WEUDOTCXYMPVAS-LVEZLNDCSA-N

Smiles

CC1N(CCN(C1)CC(=O)N)c2c(cccc2)Cc3ccccc3.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 818mg/kg (818mg/kg)   Collection of Czechoslovak Chemical Communications. Vol. 53, Pg. 1820, 1988.