Compound Identification
SMILES
CCOC(=O)C1=C(N)N(CCC#N)N=C1SC
InChIKey
InChIKey=BBAXSRWYXSMTPV-UHFFFAOYSA-N
Formula
C10H14N4O2S
Mass
254.31
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
- Superclass Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Pyrazoles
Intermediate Tree Nodes
Not available
Direct Parent
Pyrazole carboxylic acids and derivatives
Alternative Parents
Alkylarylthioethers Vinylogous thioesters Vinylogous amides Heteroaromatic compounds Carboxylic acid esters Amino acids and derivatives Sulfenyl compounds Nitriles Azacyclic compounds Primary amines Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aryl thioether - Pyrazole-4-carboxylic acid or derivatives - Alkylarylthioether - Vinylogous thioester - Vinylogous amide - Heteroaromatic compound - Amino acid or derivatives - Carboxylic acid ester - Carboxylic acid derivative - Carbonitrile - Nitrile - Thioether - Sulfenyl compound - Azacycle - Primary amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Cyanide - Amine - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as pyrazole carboxylic acids and derivatives. These are heterocyclic compounds containing a pyrazole ring in which a hydrogen atom is replaced by a carboxylic acid group.
External Descriptors
Not available