4-Acetamido-4′-isothiocyanatostilbene-2,2′-disulfonic acid

CAS Registry Number®

27816-59-7

CAS Name

4-Acetamido-4′-isothiocyanatostilbene-2,2′-disulfonic acid

Molecular Formula

C17H14N2O7S3

Molecular Mass

454.50

Cite this Page

4-Acetamido-4′-isothiocyanatostilbene-2,2′-disulfonic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=27816-59-7 (retrieved 2024-12-22) (CAS RN: 27816-59-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C17H14N2O7S3/c1-11(20)19-15-7-5-13(17(9-15)29(24,25)26)3-2-12-4-6-14(18-10-27)8-16(12)28(21,22)23/h2-9H,1H3,(H,19,20)(H,21,22,23)(H,24,25,26)

InChIKey

InChIKey=YJCCSLGGODRWKK-UHFFFAOYSA-N

SMILES

C(=CC1=C(S(=O)(=O)O)C=C(N=C=S)C=C1)C2=C(S(=O)(=O)O)C=C(NC(C)=O)C=C2

Canonical SMILES

O=C(NC1=CC=C(C=CC2=CC=C(N=C=S)C=C2S(=O)(=O)O)C(=C1)S(=O)(=O)O)C

Other Names for this Substance

  • Benzenesulfonic acid, 5-(acetylamino)-2-[2-(4-isothiocyanato-2-sulfophenyl)ethenyl]-
  • 2,2′-Stilbenedisulfonic acid, 4-acetamido-4′-isothiocyanato-
  • 5-(Acetylamino)-2-[2-(4-isothiocyanato-2-sulfophenyl)ethenyl]benzenesulfonic acid
  • 4-Acetamido-4′-isothiocyanatostilbene-2,2′-disulfonic acid
  • 4-Acetamido-4′-isothiocyanostilbene-2,2′-disulfonic acid

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CAS INSIGHTSTM
Pile of blue, green, and white color of capsule pills with modern design light.