(Q27252709)

2-(4-Methyl-5-thiazolyl)ethyl octanoate (English)

14 October 2016

chemical formula

C₁₄H₂₃NO₂S

1 reference

2-(4-Methyl-5-thiazolyl)ethyl octanoate (English)

14 October 2016

canonical SMILES

CCCCCCCC(=O)OCCC1=C(N=CS1)C

1 reference

2-(4-Methyl-5-thiazolyl)ethyl octanoate (English)

InChI=1S/C14H23NO2S/c1-3-4-5-6-7-8-14(16)17-10-9-13-12(2)15-11-18-13/h11H,3-10H2,1-2H3

14 October 2016

Identifiers

InChI

1 reference

2-(4-Methyl-5-thiazolyl)ethyl octanoate (English)

14 October 2016

1 reference

Global Substance Registration System

2-(4-Methyl-5-thiazolyl)ethyl octanoate (English)

14 October 2016

2 references

UNII

1P83YTY662

https://commonchemistry.cas.org/detail?cas_rn=163266-17-9

2-(4-methyl-5-thiazolyl)ethyl octanoate (English)

14 October 2016

2 April 2021

1 reference

2-(4-Methyl-1,3-thiazol-5-yl)ethyl octanoate (English)

14 October 2016

2 references

2-(4-Methyl-5-thiazolyl)ethyl octanoate (English)

14 October 2016

ChEBI ID

173916

mapping relation type

exact match

2 references

stated in

ChEBI release 2022-06-13

International Chemical Identifier

InChI

InChI=1S/C14H23NO2S/c1-3-4-5-6-7-8-14(16)17-10-9-13-12(2)15-11-18-13/h11H,3-10H2,1-2H3

1 reference

2 references

Mapping file of InChIStrings, InChIKeys and DTXSIDs for the EPA CompTox Dashboard

DSSTOX compound identifier

DTXCID1090036

0 references

Human Metabolome Database ID

HMDB0032423

2 references

based on heuristic

inferred from InChIKey

Global Substance Registration System

UNII

1P83YTY662

2 references

stated in

UNII

1P83YTY662

2-(4-methyl-5-thiazolyl)ethyl octanoate (English)

14 October 2016