RFN

(2R)-N-hydroxy-2-methyl-2-(methylsulfonyl)-4-(2-oxo-4-phenylpyridin-1(2H)-yl)butanamide

Created: 2011-11-04
Last modified:  2011-11-04

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Chemical Details

Formal Charge0
Atom Count45
Chiral Atom Count1
Bond Count46
Aromatic Bond Count6
2D diagram of RFN

Chemical Component Summary

Name(2R)-N-hydroxy-2-methyl-2-(methylsulfonyl)-4-(2-oxo-4-phenylpyridin-1(2H)-yl)butanamide
Systematic Name (OpenEye OEToolkits)(2R)-2-methyl-2-methylsulfonyl-N-oxidanyl-4-(2-oxidanylidene-4-phenyl-pyridin-1-yl)butanamide
FormulaC17 H20 N2 O5 S
Molecular Weight364.416
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01O=S(=O)(C(C(=O)NO)(CCN1C=CC(=CC1=O)c2ccccc2)C)C
SMILESCACTVS3.370C[C](CCN1C=CC(=CC1=O)c2ccccc2)(C(=O)NO)[S](C)(=O)=O
SMILESOpenEye OEToolkits1.7.2CC(CCN1C=CC(=CC1=O)c2ccccc2)(C(=O)NO)S(=O)(=O)C
Canonical SMILESCACTVS3.370 C[C@@](CCN1C=CC(=CC1=O)c2ccccc2)(C(=O)NO)[S](C)(=O)=O
Canonical SMILESOpenEye OEToolkits1.7.2 C[C@@](CCN1C=CC(=CC1=O)c2ccccc2)(C(=O)NO)S(=O)(=O)C
InChIInChI1.03 InChI=1S/C17H20N2O5S/c1-17(16(21)18-22,25(2,23)24)9-11-19-10-8-14(12-15(19)20)13-6-4-3-5-7-13/h3-8,10,12,22H,9,11H2,1-2H3,(H,18,21)/t17-/m1/s1
InChIKeyInChI1.03 NFQOWMXNJNMRTA-QGZVFWFLSA-N

Related Resource References

Resource NameReference
PubChem 56593152
ChEMBL CHEMBL2023131