NB7

N'-[(2-fluorophenyl)sulfonyl]benzohydrazide

Created:	2019-05-10
Last modified:	2020-04-01

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1 entries where NB7 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	31
Chiral Atom Count	0
Bond Count	32
Aromatic Bond Count	12

2D diagram of NB7

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Chemical Component Summary
Name	N'-[(2-fluorophenyl)sulfonyl]benzohydrazide
Systematic Name (OpenEye OEToolkits)	~{N}'-(2-fluorophenyl)sulfonylbenzohydrazide
Formula	C₁₃ H₁₁ F N₂ O₃ S
Molecular Weight	294.301
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	c1(ccccc1S(NNC(c2ccccc2)=O)(=O)=O)F
SMILES	CACTVS	3.385	Fc1ccccc1[S](=O)(=O)NNC(=O)c2ccccc2
SMILES	OpenEye OEToolkits	2.0.7	c1ccc(cc1)C(=O)NNS(=O)(=O)c2ccccc2F
Canonical SMILES	CACTVS	3.385	Fc1ccccc1[S](=O)(=O)NNC(=O)c2ccccc2
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1ccc(cc1)C(=O)NNS(=O)(=O)c2ccccc2F
InChI	InChI	1.03	InChI=1S/C13H11FN2O3S/c14-11-8-4-5-9-12(11)20(18,19)16-15-13(17)10-6-2-1-3-7-10/h1-9,16H,(H,15,17)
InChIKey	InChI	1.03	DNZDKRQQOYZLNO-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	16385222

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.