Compound Identification
SMILES
CC1(C)SC2C(NC(=O)CSC3=CC=CC=C3CN)C(=O)N2C1C1=NNN=N1
InChIKey
InChIKey=SBPLGEXZLLMHNN-UHFFFAOYSA-N
Formula
C17H21N7O2S2
Mass
419.52
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Lactams
-
Subclass
Beta lactams
-
Level 5
Penams
- Level 6 Penicillins
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Level 5
Penams
-
Subclass
Beta lactams
-
Class
Lactams
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Lactams
Subclass
Beta lactams
Intermediate Tree Nodes
Penams
Direct Parent
Penicillins
Alternative Parents
N-acyl-alpha amino acids and derivatives Thiophenol ethers Benzylamines Phenylmethylamines Alkylarylthioethers Aralkylamines Thiazolidines Tetrazoles Heteroaromatic compounds Tertiary carboxylic acid amides Azetidines Secondary carboxylic acid amides Azacyclic compounds Dialkylthioethers Thiohemiaminal derivatives Sulfenyl compounds Monoalkylamines Hydrocarbon derivatives Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Penicillin - N-acyl-alpha amino acid or derivatives - Alpha-amino acid or derivatives - Aryl thioether - Benzylamine - Phenylmethylamine - Thiophenol ether - Aralkylamine - Alkylarylthioether - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Tertiary carboxylic acid amide - Tetrazole - Thiazolidine - Amino acid or derivatives - Azetidine - Carboxamide group - Secondary carboxylic acid amide - Sulfenyl compound - Dialkylthioether - Thioether - Hemithioaminal - Carboxylic acid derivative - Azacycle - Organosulfur compound - Primary aliphatic amine - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Amine - Primary amine - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as penicillins. These are organic compounds containing the penicillin core structure, which is structurally characterized by a penam ring bearing two methyl groups at position 2, and an amide group at position 6 [starting from the sulfur atom at position 1].
External Descriptors
Not available