8BK

4-(1,3-thiazol-5-ylmethoxy)benzamide

Created:	2021-10-07
Last modified:	2022-08-22

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1 entries where 8BK is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	26
Chiral Atom Count	0
Bond Count	27
Aromatic Bond Count	11

2D diagram of 8BK

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Chemical Component Summary
Name	4-(1,3-thiazol-5-ylmethoxy)benzamide
Systematic Name (OpenEye OEToolkits)	4-(1,3-thiazol-5-ylmethoxy)benzamide
Formula	C₁₁ H₁₀ N₂ O₂ S
Molecular Weight	234.274
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	NC(=O)c1ccc(OCc2scnc2)cc1
SMILES	OpenEye OEToolkits	2.0.7	c1cc(ccc1C(=O)N)OCc2cncs2
Canonical SMILES	CACTVS	3.385	NC(=O)c1ccc(OCc2scnc2)cc1
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1cc(ccc1C(=O)N)OCc2cncs2
InChI	InChI	1.06	InChI=1S/C11H10N2O2S/c12-11(14)8-1-3-9(4-2-8)15-6-10-5-13-7-16-10/h1-5,7H,6H2,(H2,12,14)
InChIKey	InChI	1.06	QVXUTHMJYRUHJT-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	142600514

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.