Captodiame

CAS Registry Number®

486-17-9
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CAS Name

Captodiame

Molecular Formula

C21H29NS2

Molecular Mass

359.59

Cite this Page

Captodiame.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=486-17-9 (retrieved 2024-04-19) (CAS RN: 486-17-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C21H29NS2/c1-4-5-16-23-20-13-11-19(12-14-20)21(24-17-15-22(2)3)18-9-7-6-8-10-18/h6-14,21H,4-5,15-17H2,1-3H3

InChIKey

InChIKey=IZLPZXSZLLELBJ-UHFFFAOYSA-N

SMILES

C(SCCN(C)C)(C1=CC=C(SCCCC)C=C1)C2=CC=CC=C2

Canonical SMILES

S(C1=CC=C(C=C1)C(SCCN(C)C)C=2C=CC=CC2)CCCC

Other Names for this Substance

  • Ethanamine, 2-[[[4-(butylthio)phenyl]phenylmethyl]thio]-N,N-dimethyl-
  • Ethylamine, 2-[[p-(butylthio)-α-phenylbenzyl]thio]-N,N-dimethyl-
  • 2-[[[4-(Butylthio)phenyl]phenylmethyl]thio]-N,N-dimethylethanamine
  • 2-[[p-(Butylthio)-α-phenylbenzyl]thio]-N,N-dimethylethylamine
  • Captodiame

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