RA5

8-methoxy-2-oxidanylidene-~{N}-(4-sulfamoylphenyl)chromene-3-carboxamide

Created:	2017-05-11
Last modified:	2018-05-30

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1 entries where RA5 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	40
Chiral Atom Count	0
Bond Count	42
Aromatic Bond Count	12

2D diagram of RA5

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Chemical Component Summary
Name	8-methoxy-2-oxidanylidene-~{N}-(4-sulfamoylphenyl)chromene-3-carboxamide
Systematic Name (OpenEye OEToolkits)	8-methoxy-2-oxidanylidene-~{N}-(4-sulfamoylphenyl)chromene-3-carboxamide
Formula	C₁₇ H₁₄ N₂ O₆ S
Molecular Weight	374.368
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	COc1cccc2C=C(C(=O)Nc3ccc(cc3)[S](N)(=O)=O)C(=O)Oc12
SMILES	OpenEye OEToolkits	2.0.6	COc1cccc2c1OC(=O)C(=C2)C(=O)Nc3ccc(cc3)S(=O)(=O)N
Canonical SMILES	CACTVS	3.385	COc1cccc2C=C(C(=O)Nc3ccc(cc3)[S](N)(=O)=O)C(=O)Oc12
Canonical SMILES	OpenEye OEToolkits	2.0.6	COc1cccc2c1OC(=O)C(=C2)C(=O)Nc3ccc(cc3)S(=O)(=O)N
InChI	InChI	1.03	InChI=1S/C17H14N2O6S/c1-24-14-4-2-3-10-9-13(17(21)25-15(10)14)16(20)19-11-5-7-12(8-6-11)26(18,22)23/h2-9H,1H3,(H,19,20)(H2,18,22,23)
InChIKey	InChI	1.03	DOVOVWITCHWXJD-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	1071212
ChEMBL	CHEMBL2164284

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.