Oxythiamine

CAS Registry Number®

136-16-3

CAS Name

Oxythiamine

Molecular Formula

C12H16N3O2S

Cite this Page

Oxythiamine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=136-16-3 (retrieved 2024-11-22) (CAS RN: 136-16-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C12H15N3O2S/c1-8-11(3-4-16)18-7-15(8)6-10-5-13-9(2)14-12(10)17/h5,7,16H,3-4,6H2,1-2H3/p+1

InChIKey

InChIKey=SRDGSXVLAVRBLU-UHFFFAOYSA-O

SMILES

C([N+]=1C(C)=C(CCO)SC1)C=2C(=O)NC(C)=NC2

Canonical SMILES

O=C1NC(=NC=C1C[N+]2=CSC(=C2C)CCO)C

Other Names for this Substance

  • Thiazolium, 3-[(3,4-dihydro-2-methyl-4-oxo-5-pyrimidinyl)methyl]-5-(2-hydroxyethyl)-4-methyl-
  • Thiazolium, 5-(2-hydroxyethyl)-3-[(4-hydroxy-2-methyl-5-pyrimidinyl)methyl]-4-methyl-
  • Thiazolium, 3-[(1,4-dihydro-2-methyl-4-oxo-5-pyrimidinyl)methyl]-5-(2-hydroxyethyl)-4-methyl-
  • 3-[(3,4-Dihydro-2-methyl-4-oxo-5-pyrimidinyl)methyl]-5-(2-hydroxyethyl)-4-methylthiazolium
  • Oxythiamine

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration