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Substance Name: Benzenemethanamine, 2-((2,4-dimethoxyphenyl)thio)-N,N-dimethyl-, (Z)-2-butenedioate (1:1)
RN: 127905-76-4
InChIKey: UFDHVTLFAGJEJC-WLHGVMLRSA-N
Classification Code
- Drug / Therapeutic Agent
Molecular Formula
- C17-H21-N-O2-S.C4-H4-O4
Molecular Weight
- 419.4955
Names and Synonyms
Synonym
- N,N-Dimethyl-2-(2,4-dimethoxyphenylthio)benzylamine
Systematic Name
- Benzenemethanamine, 2-((2,4-dimethoxyphenyl)thio)-N,N-dimethyl-, (Z)-2-butenedioate (1:1)
Registry Numbers
CAS Registry Number
- 127905-76-4
System Generated Number
- 0127905764
Molecular Formulas
Molecular Formula
- C17-H21-N-O2-S.C4-H4-O4
Molecular Formula Fragments
- C17-H21-N-O2-S
- C4-H4-O4
- COMPONENT
Structure Descriptors
InChI
1S/C17H21NO2S.C4H4O4/c1-18(2)12-13-7-5-6-8-16(13)21-17-10-9-14(19-3)11-15(17)20-4;5-3(6)1-2-4(7)8/h5-11H,12H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b;2-1+InChIKey
UFDHVTLFAGJEJC-WLHGVMLRSA-NSmiles
CN(C)Toxicity
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intravenous | 41mg/kg (41mg/kg) | Collection of Czechoslovak Chemical Communications. Vol. 54, Pg. 3294, 1989. |