U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C25H21N3O3S
Molecular Weight 443.518
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of N-TRITYL CEFTIOFUR OXIME

SMILES

CO\N=C(/C(O)=O)C1=CSC(NC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)=N1

InChI

InChIKey=PKPGSMOHYWOGJR-SLMZUGIISA-N
InChI=1S/C25H21N3O3S/c1-31-28-22(23(29)30)21-17-32-24(26-21)27-25(18-11-5-2-6-12-18,19-13-7-3-8-14-19)20-15-9-4-10-16-20/h2-17H,1H3,(H,26,27)(H,29,30)/b28-22-

HIDE SMILES / InChI

Molecular Formula C25H21N3O3S
Molecular Weight 443.518
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 Sat Dec 16 11:05:27 GMT 2023
Edited
by admin
on Sat Dec 16 11:05:27 GMT 2023
Record UNII
9FS2IS2HR2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-TRITYL CEFTIOFUR OXIME
Common Name English
4-THIAZOLEACETIC ACID, .ALPHA.-(METHOXYIMINO)-2-((TRIPHENYLMETHYL)AMINO)-, (.ALPHA.Z)-
Systematic Name English
(Z)-2-(METHOXYIMINO)-2-(2-(TRITYLAMINO)THIAZOL-4-YL)ACETIC ACID
Systematic Name English
CEFTIOFUR RELATED COMPOUND J [USP IMPURITY]
Common Name English
N-TRITYL CEFTIOFUR OXIME [USP IMPURITY]
Common Name English
Code System Code Type Description
FDA UNII
9FS2IS2HR2
Created by admin on Sat Dec 16 11:05:27 GMT 2023 , Edited by admin on Sat Dec 16 11:05:27 GMT 2023
PRIMARY
CAS
64485-90-1
Created by admin on Sat Dec 16 11:05:27 GMT 2023 , Edited by admin on Sat Dec 16 11:05:27 GMT 2023
PRIMARY
EPA CompTox
DTXSID70983053
Created by admin on Sat Dec 16 11:05:27 GMT 2023 , Edited by admin on Sat Dec 16 11:05:27 GMT 2023
PRIMARY
PUBCHEM
5928144
Created by admin on Sat Dec 16 11:05:27 GMT 2023 , Edited by admin on Sat Dec 16 11:05:27 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> IMPURITY
CHROMATOGRAPHIC PURITY (HPLC/UV)
USP