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Substance Name: 2-Thiophenemethanamine, N,N-dimethyl-alpha-ethyl-alpha-(3-(3,4,5-trimethoxyphenyl)propyl)-
RN: 120656-45-3
InChIKey: IRVSXFXWSUCMQE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H31-N-O3-S

Molecular Weight

  • 377.5459
 
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Names and Synonyms

Synonyms

  • 1-Ethyl-4-(3,4,5-trimethoxyphenyl)-1-(2-thienyl)-N,N-dimethylbutylamine
  • N,N-Dimethyl-alpha-ethyl-alpha-(3-(3,4,5-trimethoxyphenyl)propyl)-2-thiophenemethanamine

Systematic Name

  • 2-Thiophenemethanamine, N,N-dimethyl-alpha-ethyl-alpha-(3-(3,4,5-trimethoxyphenyl)propyl)-

Registry Numbers

CAS Registry Number

  • 120656-45-3

System Generated Number

  • 0120656453

Structure Descriptors

InChI

1S/C21H31NO3S/c1-7-21(22(2)3,19-11-9-13-26-19)12-8-10-16-14-17(23-4)20(25-6)18(15-16)24-5/h9,11,13-15H,7-8,10,12H2,1-6H3

InChIKey

IRVSXFXWSUCMQE-UHFFFAOYSA-N

Smiles

CCC(CCCc1cc(c(c(c1)OC)OC)OC)(c2cccs2)N(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1gm/kg (1000mg/kg)   Japanese Kokai Tokyo Koho Patents. Vol. #90-256613,