Hydroxystilbamidine isethionate

CAS Registry Number®

533-22-2

CAS Name

Hydroxystilbamidine isethionate

Molecular Formula

C16H16N4O.2C2H6O4S

Cite this Page

Hydroxystilbamidine isethionate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=533-22-2 (retrieved 2024-11-21) (CAS RN: 533-22-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    286 °C (decomp)

Source(s)

  • (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

InChI

InChI=1S/C16H16N4O.C2H6O4S/c17-15(18)12-5-2-10(3-6-12)1-4-11-7-8-13(16(19)20)9-14(11)21;3-1-2-7(4,5)6/h1-9,21H,(H3,17,18)(H3,19,20);3H,1-2H2,(H,4,5,6)

InChIKey

InChIKey=HPLUMRXCPMTSQW-UHFFFAOYSA-N

SMILES

C(=CC1=CC=C(C(=N)N)C=C1)C2=C(O)C=C(C(=N)N)C=C2.C(S(=O)(=O)O)CO

Canonical SMILES

O=S(=O)(O)CCO.N=C(N)C1=CC=C(C=C1)C=CC2=CC=C(C=C2O)C(=N)N

Other Names for this Substance

  • Ethanesulfonic acid, 2-hydroxy-, compd. with 4-[2-[4-(aminoiminomethyl)phenyl]ethenyl]-3-hydroxybenzenecarboximidamide (2:1)
  • Ethanesulfonic acid, 2-hydroxy-, compd. with 2-hydroxy-4,4′-stilbenedicarboxamidine (2:1)
  • 4,4′-Stilbenedicarboxamidine, 2-hydroxy-, diisethionate
  • Benzenecarboximidamide, 4-[2-[4-(aminoiminomethyl)phenyl]ethenyl]-3-hydroxy-, bis(2-hydroxyethanesulfonate) (salt)
  • 2-Hydroxy-4,4′-diamidinostilbene di(β-hydroxyethanesulfonate)

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration