Compound Identification
SMILES
O=C(C1CCCCC1)N1CC2=C(C1)C(=NN2)C1=CSC=C1
InChIKey
InChIKey=ZFXKAXOHKOCEBW-UHFFFAOYSA-N
Formula
C16H19N3OS
Mass
301.41
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyrrolopyrazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolopyrazoles
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyrrolopyrazoles
Alternative Parents
Thiophenes Tertiary carboxylic acid amides Pyrroles Pyrazoles Heteroaromatic compounds Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrrolopyrazole - Azole - Pyrazole - Pyrrole - Tertiary carboxylic acid amide - Thiophene - Heteroaromatic compound - Carboxamide group - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Carbonyl group - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrrolopyrazoles. These are polycyclic aromatic compounds containing a pyrrole fused to a pyrazole ring. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Pyrazole is a 5-membered ring consisting of three carbon atoms and two adjacent nitrogen centers.
External Descriptors
Not available