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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H18N10O5S3
Molecular Weight 514.562
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of S-Decyanomethyl-S-(1-methyl-1H-tetrazol-5-yl) Cefmetazole

SMILES

CO[C@]2(NC(=O)CSC1=NN=NN1C)[C@H]3SCC(CSC4=NN=NN4C)=C(N3C2=O)C(O)=O

InChI

InChIKey=KQMPASGWEJSRBK-DOMZBBRYSA-N
InChI=1S/C15H18N10O5S3/c1-23-13(17-19-21-23)32-5-7-4-31-12-15(30-3,11(29)25(12)9(7)10(27)28)16-8(26)6-33-14-18-20-22-24(14)2/h12H,4-6H2,1-3H3,(H,16,26)(H,27,28)/t12-,15+/m1/s1

HIDE SMILES / InChI

Approval Year

Name Type Language
S-Decyanomethyl-S-(1-methyl-1H-tetrazol-5-yl) Cefmetazole
Systematic Name English
5-Thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid, 7-methoxy-7-[[[(1-methyl-1H-tetrazol-5-yl)thio]acetyl]amino]-3-[[(1-methyl-1H-tetrazol-5-yl)thio]methyl]-8-oxo-, (6R-cis)-
Preferred Name English
Code System Code Type Description
CAS
74228-11-8
Created by admin on Wed Apr 02 17:22:22 GMT 2025 , Edited by admin on Wed Apr 02 17:22:22 GMT 2025
PRIMARY
PUBCHEM
71315254
Created by admin on Wed Apr 02 17:22:22 GMT 2025 , Edited by admin on Wed Apr 02 17:22:22 GMT 2025
PRIMARY
EPA CompTox
DTXSID30747431
Created by admin on Wed Apr 02 17:22:22 GMT 2025 , Edited by admin on Wed Apr 02 17:22:22 GMT 2025
PRIMARY
FDA UNII
N4S3FL77SS
Created by admin on Wed Apr 02 17:22:22 GMT 2025 , Edited by admin on Wed Apr 02 17:22:22 GMT 2025
PRIMARY