ENN

~{N}-butyl-2,4-bis(chloranyl)-5-sulfamoyl-benzamide

Created:	2018-04-02
Last modified:	2019-03-13

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2 entries where ENN is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	33
Chiral Atom Count	0
Bond Count	33
Aromatic Bond Count	6

2D diagram of ENN

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Chemical Component Summary
Name	~{N}-butyl-2,4-bis(chloranyl)-5-sulfamoyl-benzamide
Systematic Name (OpenEye OEToolkits)	~{N}-butyl-2,4-bis(chloranyl)-5-sulfamoyl-benzamide
Formula	C₁₁ H₁₄ Cl₂ N₂ O₃ S
Molecular Weight	325.211
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	CCCCNC(=O)c1cc(c(Cl)cc1Cl)[S](N)(=O)=O
SMILES	OpenEye OEToolkits	2.0.6	CCCCNC(=O)c1cc(c(cc1Cl)Cl)S(=O)(=O)N
Canonical SMILES	CACTVS	3.385	CCCCNC(=O)c1cc(c(Cl)cc1Cl)[S](N)(=O)=O
Canonical SMILES	OpenEye OEToolkits	2.0.6	CCCCNC(=O)c1cc(c(cc1Cl)Cl)S(=O)(=O)N
InChI	InChI	1.03	InChI=1S/C11H14Cl2N2O3S/c1-2-3-4-15-11(16)7-5-10(19(14,17)18)9(13)6-8(7)12/h5-6H,2-4H2,1H3,(H,15,16)(H2,14,17,18)
InChIKey	InChI	1.03	KRIUYRKSVUBELV-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
Pharos	CHEMBL4160149
PubChem	34852311
ChEMBL	CHEMBL4160149

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.