Mrv0541 08131413162D          

  8  8  0  0  0  0            999 V2000
    6.4717  -26.3271    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    6.0732  -27.5904    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    6.7426  -27.1080    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.6518  -26.3271    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4108  -27.1160    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6293  -27.3806    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.0095  -26.8362    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2280  -27.1007    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
  3  1  2  0  0  0  0
  4  1  1  0  0  0  0
  3  2  1  0  0  0  0
  5  2  1  0  0  0  0
  5  4  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
M  END
> <ID>
CHEBI:82687

> <NAME>
5-(2-hydroxyethyl)-1,3-thiazole

> <DEFINITION>
A 1,3-thiazole in which the only substituent is a 2-hydroxyethyl group at position 5.

> <STAR>
3

> <SYNONYM>
5-(beta-hydroxyethyl)thiazole; 5-(beta-hydroxyethyl)-1,3-thiazole; 5-(2-hydroxyethyl)thiazole; 2-thiazol-5-ylethanol

> <IUPAC_NAME>
2-(1,3-thiazol-5-yl)ethanol

> <FORMULA>
C5H7NOS

> <MASS>
129.18000

> <MONOISOTOPIC_MASS>
129.02484

> <CHARGE>
0

> <SMILES>
OCCc1cncs1

> <INCHI>
InChI=1S/C5H7NOS/c7-2-1-5-3-6-4-8-5/h3-4,7H,1-2H2

> <INCHIKEY>
MWSQHVUUIHWHBM-UHFFFAOYSA-N

> <REAXYS_REGISTRY_NUMBER>
970356

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