MQJ

2-fluoro-N'-[(naphthalen-2-yl)sulfonyl]benzohydrazide

Created:	2019-04-10
Last modified:	2019-07-03

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1 entries where MQJ is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	37
Chiral Atom Count	0
Bond Count	39
Aromatic Bond Count	17

2D diagram of MQJ

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Chemical Component Summary
Name	2-fluoro-N'-[(naphthalen-2-yl)sulfonyl]benzohydrazide
Systematic Name (OpenEye OEToolkits)	2-fluoranyl-~{N}'-naphthalen-2-ylsulfonyl-benzohydrazide
Formula	C₁₇ H₁₃ F N₂ O₃ S
Molecular Weight	344.36
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	C(=O)(c1ccccc1F)NNS(=O)(=O)c3cc2ccccc2cc3
SMILES	CACTVS	3.385	Fc1ccccc1C(=O)NN[S](=O)(=O)c2ccc3ccccc3c2
SMILES	OpenEye OEToolkits	2.0.7	c1ccc2cc(ccc2c1)S(=O)(=O)NNC(=O)c3ccccc3F
Canonical SMILES	CACTVS	3.385	Fc1ccccc1C(=O)NN[S](=O)(=O)c2ccc3ccccc3c2
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1ccc2cc(ccc2c1)S(=O)(=O)NNC(=O)c3ccccc3F
InChI	InChI	1.03	InChI=1S/C17H13FN2O3S/c18-16-8-4-3-7-15(16)17(21)19-20-24(22,23)14-10-9-12-5-1-2-6-13(12)11-14/h1-11,20H,(H,19,21)
InChIKey	InChI	1.03	CMGWGSMHPCWLOH-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	877350

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.