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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H13Cl2N3O5S
Molecular Weight 418.252
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-[[2-(3,5-dichloro-4-oxopyridin-1-yl)acetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7R)-

SMILES

CC1=C(N2[C@H](SC1)[C@H](NC(=O)CN3C=C(Cl)C(=O)C(Cl)=C3)C2=O)C(O)=O

InChI

InChIKey=HIOXARKGMQFYCS-QMTHXVAHSA-N
InChI=1S/C15H13Cl2N3O5S/c1-6-5-26-14-10(13(23)20(14)11(6)15(24)25)18-9(21)4-19-2-7(16)12(22)8(17)3-19/h2-3,10,14H,4-5H2,1H3,(H,18,21)(H,24,25)/t10-,14-/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
Cefazedone Related Impurity 4
Preferred Name English
7-[[2-(3,5-dichloro-4-oxopyridin-1-yl)acetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, (6R,7R)-
Systematic Name English
5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-[[(3,5-dichloro-4-oxo-1(4H)-pyridinyl)acetyl]amino]-3-methyl-8-oxo-, (6R-trans)-
Systematic Name English
(6R,7R)-7-[[2-(3,5-dichloro-4-oxopyridin-1-yl)acetyl]amino]-3-methyl-8-oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid
Systematic Name English
Code System Code Type Description
PUBCHEM
131883702
Created by admin on Wed Apr 02 17:11:55 GMT 2025 , Edited by admin on Wed Apr 02 17:11:55 GMT 2025
PRIMARY
EPA CompTox
DTXSID101101571
Created by admin on Wed Apr 02 17:11:55 GMT 2025 , Edited by admin on Wed Apr 02 17:11:55 GMT 2025
PRIMARY
CAS
70149-63-2
Created by admin on Wed Apr 02 17:11:55 GMT 2025 , Edited by admin on Wed Apr 02 17:11:55 GMT 2025
PRIMARY
FDA UNII
7D7NP9ZED2
Created by admin on Wed Apr 02 17:11:55 GMT 2025 , Edited by admin on Wed Apr 02 17:11:55 GMT 2025
PRIMARY