Compound Identification
SMILES
CCOC(=O)C(=C1/NN=C(N)S1)\C1=NCCN1
InChIKey
InChIKey=IQVMZINOUPKQCS-FNORWQNLSA-N
Formula
C9H13N5O2S
Mass
255.3
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Azoles
-
Subclass
Imidazoles
- Level 5 Substituted imidazoles
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Subclass
Imidazoles
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Class
Azoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Imidazoles
Intermediate Tree Nodes
Substituted imidazoles
Direct Parent
Imidazolyl carboxylic acids and derivatives
Alternative Parents
Imidolactams Vinylogous amides Thiadiazolines Enoate esters Imidazolines Ketene acetals Azacyclic compounds Carboxamidines Carboximidamides Propargyl-type 1,3-dipolar organic compounds Monocarboxylic acids and derivatives Hydrazones Carbonyl compounds Hydrocarbon derivatives Organic oxides Amines
Molecular Framework
Aliphatic heteromonocyclic compounds
Substituents
Imidazolyl carboxylic acid derivative - Imidolactam - 2-imidazoline - Thiadiazoline - Vinylogous amide - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Carboxylic acid ester - Ketene acetal or derivatives - Amidine - Carboxylic acid amidine - Carboxylic acid derivative - Hydrazone - Monocarboxylic acid or derivatives - Azacycle - Carboximidamide - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Amine - Organic nitrogen compound - Carbonyl group - Organic oxygen compound - Aliphatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as imidazolyl carboxylic acids and derivatives. These are organic compounds containing a carboxylic acid chain (of at least 2 carbon atoms) linked to an imidazole ring.
External Descriptors
Not available