10B

N-2-(biphenyl-4-ylsulfonyl)-N-2-(isopropyloxy)-acetohydroxamic acid

Created:	2012-09-18
Last modified:	2021-03-01

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2 entries where 10B is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	45
Chiral Atom Count	0
Bond Count	46
Aromatic Bond Count	12

2D diagram of 10B

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Chemical Component Summary
Name	N-2-(biphenyl-4-ylsulfonyl)-N-2-(isopropyloxy)-acetohydroxamic acid
Synonyms	N~2~-(biphenyl-4-ylsulfonyl)-N-hydroxy-N~2~-(propan-2-yloxy)glycinamide
Systematic Name (OpenEye OEToolkits)	N-oxidanyl-2-[(4-phenylphenyl)sulfonyl-propan-2-yloxy-amino]ethanamide
Formula	C₁₇ H₂₀ N₂ O₅ S
Molecular Weight	364.416
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=S(=O)(N(OC(C)C)CC(=O)NO)c2ccc(c1ccccc1)cc2
SMILES	CACTVS	3.370	CC(C)ON(CC(=O)NO)[S](=O)(=O)c1ccc(cc1)c2ccccc2
SMILES	OpenEye OEToolkits	1.7.6	CC(C)ON(CC(=O)NO)S(=O)(=O)c1ccc(cc1)c2ccccc2
Canonical SMILES	CACTVS	3.370	CC(C)ON(CC(=O)NO)[S](=O)(=O)c1ccc(cc1)c2ccccc2
Canonical SMILES	OpenEye OEToolkits	1.7.6	CC(C)ON(CC(=O)NO)S(=O)(=O)c1ccc(cc1)c2ccccc2
InChI	InChI	1.03	InChI=1S/C17H20N2O5S/c1-13(2)24-19(12-17(20)18-21)25(22,23)16-10-8-15(9-11-16)14-6-4-3-5-7-14/h3-11,13,21H,12H2,1-2H3,(H,18,20)
InChIKey	InChI	1.03	PHGLPDURIUEELR-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
Pharos	CHEMBL181244
PubChem	10044321
ChEMBL	CHEMBL181244

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.