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Details

Stereochemistry ACHIRAL
Molecular Formula C16H14N2O6S
Molecular Weight 362.357
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of Ceftibuten Related Impurity 1

SMILES

OC(=O)CC=C(C(O)=O)C1=CSC(NC(=O)OCC2=CC=CC=C2)=N1

InChI

InChIKey=KCJOTWMQVWNZSP-IZZDOVSWSA-N
InChI=1S/C16H14N2O6S/c19-13(20)7-6-11(14(21)22)12-9-25-15(17-12)18-16(23)24-8-10-4-2-1-3-5-10/h1-6,9H,7-8H2,(H,19,20)(H,21,22)(H,17,18,23)/b11-6+

HIDE SMILES / InChI

Molecular Formula C16H14N2O6S
Molecular Weight 362.357
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 21:09:59 GMT 2025
Edited
by admin
on Wed Apr 02 21:09:59 GMT 2025
Record UNII
7FA3S8ZC2C
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Pentenedioic acid, 2-[2-[[(phenylmethoxy)carbonyl]amino]-4-thiazolyl]-
Preferred Name English
Ceftibuten Related Impurity 1
Common Name English
2-[2-[[(Phenylmethoxy)carbonyl]amino]-4-thiazolyl]-2-pentenedioic acid
Systematic Name English
2-[2-[[(Benzyloxy)carbonyl]amino]-4-thiazolyl]pent-2-enedioic acid
Systematic Name English
Code System Code Type Description
CAS
102199-53-1
Created by admin on Wed Apr 02 21:09:59 GMT 2025 , Edited by admin on Wed Apr 02 21:09:59 GMT 2025
PRIMARY
PUBCHEM
57357263
Created by admin on Wed Apr 02 21:09:59 GMT 2025 , Edited by admin on Wed Apr 02 21:09:59 GMT 2025
PRIMARY
FDA UNII
7FA3S8ZC2C
Created by admin on Wed Apr 02 21:09:59 GMT 2025 , Edited by admin on Wed Apr 02 21:09:59 GMT 2025
PRIMARY
EPA CompTox
DTXSID00723601
Created by admin on Wed Apr 02 21:09:59 GMT 2025 , Edited by admin on Wed Apr 02 21:09:59 GMT 2025
PRIMARY