EMPA (drug)

EMPA
Clinical data
ATC code	none;
Identifiers
	IUPAC name N-Ethyl-N2-(6-methoxy-3-pyridinyl)-N2-[(2-methylphenyl)sulfonyl]-N-(3-pyridinylmethyl)glycinamide;
CAS Number	680590-49-2 ;
PubChem CID	9981404;
ChemSpider	8156996;
UNII	VT87V86D7W;
CompTox Dashboard (EPA)	DTXSID101045254 ;
ECHA InfoCard	100.233.393
Chemical and physical data
Formula	C23H26N4O4S
Molar mass	454.55 g·mol−1
3D model (JSmol)	Interactive image;
	SMILES CCN(CC1=CN=CC=C1)C(=O)CN(C2=CN=C(C=C2)OC)S(=O)(=O)C3=CC=CC=C3C;
	InChI InChI=1S/C23H26N4O4S/c1-4-26(16-19-9-7-13-24-14-19)23(28)17-27(20-11-12-22(31-3)25-15-20)32(29,30)21-10-6-5-8-18(21)2/h5-15H,4,16-17H2,1-3H3; Key:KJPHTXTWFHVJIG-UHFFFAOYSA-N;

EMPA is a selective antagonist of the OX₂ receptor, with 900-fold selectivity in binding for OX₂ over OX₁.

Clinical data

ATC code	none
Identifiers
IUPAC name N-Ethyl-N²-(6-methoxy-3-pyridinyl)-N²-[(2-methylphenyl)sulfonyl]-N-(3-pyridinylmethyl)glycinamide
CAS Number	680590-49-2^Y
PubChem CID	9981404
ChemSpider	8156996
UNII	VT87V86D7W
CompTox Dashboard (EPA)	DTXSID101045254
ECHA InfoCard	100.233.393
Chemical and physical data
Formula	C₂₃H₂₆N₄O₄S
Molar mass	454.55 g·mol⁻¹
3D model (JSmol)	Interactive image
SMILES CCN(CC1=CN=CC=C1)C(=O)CN(C2=CN=C(C=C2)OC)S(=O)(=O)C3=CC=CC=C3C
InChI InChI=1S/C23H26N4O4S/c1-4-26(16-19-9-7-13-24-14-19)23(28)17-27(20-11-12-22(31-3)25-15-20)32(29,30)21-10-6-5-8-18(21)2/h5-15H,4,16-17H2,1-3H3 Key:KJPHTXTWFHVJIG-UHFFFAOYSA-N