Benzothiazolium, 5-chloro-2-[2-[3-[2-(5-chloro-3-ethyl-2(3H)-benzothiazolylidene)ethylidene]-2-(diphenylamino)-1-cyclopenten-1-yl]ethenyl]-3-ethyl-, perchlorate (1:1)

CAS Registry Number®

53655-17-7
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CAS Name

Benzothiazolium, 5-chloro-2-[2-[3-[2-(5-chloro-3-ethyl-2(3H)-benzothiazolylidene)ethylidene]-2-(diphenylamino)-1-cyclopenten-1-yl]ethenyl]-3-ethyl-, perchlorate (1:1)

Molecular Formula

C39H34Cl2N3S2.ClO4

Cite this Page

Benzothiazolium, 5-chloro-2-[2-[3-[2-(5-chloro-3-ethyl-2(3H)-benzothiazolylidene)ethylidene]-2-(diphenylamino)-1-cyclopenten-1-yl]ethenyl]-3-ethyl-, perchlorate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=53655-17-7 (retrieved 2024-04-29) (CAS RN: 53655-17-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C39H34Cl2N3S2.ClHO4/c1-3-42-33-25-29(40)19-21-35(33)45-37(42)23-17-27-15-16-28(18-24-38-43(4-2)34-26-30(41)20-22-36(34)46-38)39(27)44(31-11-7-5-8-12-31)32-13-9-6-10-14-32;2-1(3,4)5/h5-14,17-26H,3-4,15-16H2,1-2H3;(H,2,3,4,5)/q+1;/p-1

InChIKey

InChIKey=UVLDECUUBLLYRG-UHFFFAOYSA-M

SMILES

N(C=1C(=CC=C2N(CC)C=3C(S2)=CC=C(Cl)C3)CCC1C=CC4=[N+](CC)C=5C(S4)=CC=C(Cl)C5)(C6=CC=CC=C6)C7=CC=CC=C7.Cl(=O)(=O)(=O)[O-]

Canonical SMILES

O=Cl(=O)(=O)[O-].ClC1=CC=C2SC(=CC=C3C(=C(C=CC=4SC=5C=CC(Cl)=CC5[N+]4CC)CC3)N(C=6C=CC=CC6)C=7C=CC=CC7)N(C2=C1)CC

Other Names for this Substance

  • Benzothiazolium, 5-chloro-2-[2-[3-[2-(5-chloro-3-ethyl-2(3H)-benzothiazolylidene)ethylidene]-2-(diphenylamino)-1-cyclopenten-1-yl]ethenyl]-3-ethyl-, perchlorate (1:1)
  • Benzothiazolium, 5-chloro-2-[2-[3-[(5-chloro-3-ethyl-2(3H)-benzothiazolylidene)ethylidene]-2-(diphenylamino)-1-cyclopenten-1-yl]ethenyl]-3-ethyl-, perchlorate
  • 5,5′-Dichloro-11-(diphenylamino)-3,3′-diethyl-10,12-ethylenethiatricarbocyanine perchlorate
  • Kodak IR 140
  • IR 140

Deleted or Replaced CAS Registry Numbers

57035-55-9, 163968-98-7

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