6RO

~{N}-(4-chlorophenyl)methanesulfonamide

Created:	2016-06-07
Last modified:	2016-07-27

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2 entries where 6RO is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	20
Chiral Atom Count	0
Bond Count	20
Aromatic Bond Count	6

2D diagram of 6RO

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Chemical Component Summary
Name	~{N}-(4-chlorophenyl)methanesulfonamide
Systematic Name (OpenEye OEToolkits)	~{N}-(4-chlorophenyl)methanesulfonamide
Formula	C₇ H₈ Cl N O₂ S
Molecular Weight	205.662
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	C[S](=O)(=O)Nc1ccc(Cl)cc1
SMILES	OpenEye OEToolkits	2.0.5	CS(=O)(=O)Nc1ccc(cc1)Cl
Canonical SMILES	CACTVS	3.385	C[S](=O)(=O)Nc1ccc(Cl)cc1
Canonical SMILES	OpenEye OEToolkits	2.0.5	CS(=O)(=O)Nc1ccc(cc1)Cl
InChI	InChI	1.03	InChI=1S/C7H8ClNO2S/c1-12(10,11)9-7-4-2-6(8)3-5-7/h2-5,9H,1H3
InChIKey	InChI	1.03	TZBQEYJPVLKASB-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	706838
CCDC/CSD	FIRGOD

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.