Compound Identification
SMILES
C[N+]1=C(SCSC2=C(N3C(SC2)C(NC(=O)CSC2=C(Cl)C=CC(Cl)=C2)C3=O)C([O-])=O)C=C(N)N=C1N
InChIKey
InChIKey=NAKXBNHNPRWSRI-UHFFFAOYSA-N
Formula
C21H20Cl2N6O4S4
Mass
619.57
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
-
Level 5
Cephems
- Level 6 Cephalosporins
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Level 5
Cephems
-
Subclass
Beta lactams
-
Class
Lactams
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Lactams
Subclass
Beta lactams
Intermediate Tree Nodes
Cephems
Direct Parent
Cephalosporins
Alternative Parents
N-acyl-alpha amino acids and derivatives Thiophenol ethers Dichlorobenzenes Aminopyrimidines and derivatives Alkylarylthioethers Vinylogous thioesters Imidolactams Aryl chlorides 1,3-thiazines Dithioacetals Heteroaromatic compounds Tertiary carboxylic acid amides Thioenol ethers Carboxylic acid salts Azetidines Secondary carboxylic acid amides Amino acids Carboxylic acids Monocarboxylic acids and derivatives Azacyclic compounds Thiohemiaminal derivatives Dialkylthioethers Sulfenyl compounds Carbonyl compounds Hydrocarbon derivatives Organic oxides Organic salts Organic zwitterions Organochlorides Primary amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cephalosporin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Aryl thioether - 1,4-dichlorobenzene - Thiophenol ether - Halobenzene - Aminopyrimidine - Chlorobenzene - Alkylarylthioether - Aryl halide - Imidolactam - Vinylogous thioester - Benzenoid - Monocyclic benzene moiety - Pyrimidine - Aryl chloride - Meta-thiazine - Thioacetal - Heteroaromatic compound - Tertiary carboxylic acid amide - Secondary carboxylic acid amide - Carboxamide group - Azetidine - Amino acid - Amino acid or derivatives - Thioenolether - Carboxylic acid salt - Azacycle - Dialkylthioether - Sulfenyl compound - Carboxylic acid derivative - Hemithioaminal - Carboxylic acid - Thioether - Monocarboxylic acid or derivatives - Hydrocarbon derivative - Organic oxide - Amine - Carbonyl group - Organic zwitterion - Organic oxygen compound - Organic nitrogen compound - Primary amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic salt - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cephalosporins. These are compounds containing a 1,2-thiazine fused to a 2-azetidinone to for a oxo-5-thia-1-azabicyclo[4.2.0]oct-2-ene-2-carboxylic acid moiety or a derivative thereof.
External Descriptors
Not available