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Substance Name: Benzoic acid, thio-, S-3-(diethylamino)propyl ester, hydrochloride
ID: DH69060000
InChIKey: JFBYBHZTGSMHHU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H21-N-O-S.Cl-H

Molecular Weight

  • 287.8528
 
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Names and Synonyms

Synonyms

  • 1-Propanethiol, 3-(diethylamino)-, benzoate, hydrochloride
  • Thiobenzoic acid S-3-(diethylamino)propyl ester hydrochloride

Systematic Name

  • Benzoic acid, thio-, S-3-(diethylamino)propyl ester, hydrochloride

Registry Numbers

ID Number

  • NIOSH/DH6906000

System Generated Number

  • DH69060000

Molecular Formulas

Molecular Formula

  • C14-H21-N-O-S.Cl-H

Molecular Formula Fragments

  • C14-H21-N-O-S
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C14H21NOS.ClH/c1-3-15(4-2)11-8-12-17-14(16)13-9-6-5-7-10-13;/h5-7,9-10H,3-4,8,11-12H2,1-2H3;1H

InChIKey

JFBYBHZTGSMHHU-UHFFFAOYSA-N

Smiles

Cl.CCN(CC)CCCSC(=O)c1ccccc1