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Substance Name: Ethylmethylthiambutene [INN:BAN:DCF]
RN: 441-61-2
UNII: 722BFZ899Q
InChIKey: MORSAEFGQPDBKM-UHFFFAOYSA-N

Classification Code

  • DEA Schedule I

Molecular Formula

  • C15-H19-N-S2

Molecular Weight

  • 277.454
 
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Names and Synonyms

Name of Substance

  • Ethylmethylthiambutene [INN:BAN:DCF]

Synonyms

  • Aethylmethylthiambutenum
  • EINECS 207-128-8
  • Emethibutin
  • Ethylmethylthiambutene
  • Ethylmethylthiambutenum
  • Ethylmethylthiambutenum [INN-Latin]
  • Etilmetiltiambutene
  • Etilmetiltiambutene [DCIT]
  • Etilmetiltiambuteno
  • Etilmetiltiambuteno [INN-Spanish]
  • N-Ethyl-N,1-dimethyl-3,3-di-2-thienylallylamine
  • NIH 5145
  • UNII-722BFZ899Q

Systematic Names

  • 3-Buten-2-amine, N-ethyl-N-methyl-4,4-di-2-thienyl-
  • 3-Ethylmethylamino-1,1-di-(2'-thienyl)-1-butene
  • Allylamine, N-ethyl-N,1-dimethyl-3,3-di-2-thienyl-
  • Ethylmethylthiambutene

Superlist Names

  • DEA No. 9623
  • Ethylmethylthiambutene

Registry Numbers

CAS Registry Number

  • 441-61-2

FDA UNII

  • 722BFZ899Q

System Generated Number

  • 0000441612

Structure Descriptors

InChI

1S/C15H19NS2/c1-4-16(3)12(2)11-13(14-7-5-9-17-14)15-8-6-10-18-15/h5-12H,4H2,1-3H3

InChIKey

MORSAEFGQPDBKM-UHFFFAOYSA-N

Smiles

C(\c1cccs1)(c1cccs1)=C/[C@@H]([N@@](CC)C)C

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 4.020 (none)   EST
Atmospheric OH Rate Constant 1.99E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.