VWY

N-ethyl-4-[(methylsulfonyl)amino]benzamide

Created:	2020-09-17
Last modified:	2020-09-30

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2 entries where VWY is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	30
Chiral Atom Count	0
Bond Count	30
Aromatic Bond Count	6

2D diagram of VWY

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Chemical Component Summary
Name	N-ethyl-4-[(methylsulfonyl)amino]benzamide
Systematic Name (OpenEye OEToolkits)	~{N}-ethyl-4-(methylsulfonylamino)benzamide
Formula	C₁₀ H₁₄ N₂ O₃ S
Molecular Weight	242.295
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	N(CC)C(c1ccc(cc1)NS(C)(=O)=O)=O
SMILES	CACTVS	3.385	CCNC(=O)c1ccc(N[S](C)(=O)=O)cc1
SMILES	OpenEye OEToolkits	2.0.7	CCNC(=O)c1ccc(cc1)NS(=O)(=O)C
Canonical SMILES	CACTVS	3.385	CCNC(=O)c1ccc(N[S](C)(=O)=O)cc1
Canonical SMILES	OpenEye OEToolkits	2.0.7	CCNC(=O)c1ccc(cc1)NS(=O)(=O)C
InChI	InChI	1.03	InChI=1S/C10H14N2O3S/c1-3-11-10(13)8-4-6-9(7-5-8)12-16(2,14)15/h4-7,12H,3H2,1-2H3,(H,11,13)
InChIKey	InChI	1.03	GWMALJVYSHCCNB-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	961974

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.