Compound Identification
SMILES
CN(C)C(=O)C(=C/C1=CC=C(NC2=CN=C3NC=C(C(=O)C(C)(C)C)C3=N2)S1)\C#N
InChIKey
InChIKey=ZNSOFVVOQGNYJR-WQLSENKSSA-N
Formula
C21H22N6O2S
Mass
422.51
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyrrolopyrazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolopyrazines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyrrolopyrazines
Alternative Parents
Aryl alkyl ketones N-arylated-2-aminothiophenes Aminopyrazines 2,5-disubstituted thiophenes Substituted pyrroles Imidolactams Vinylogous amides Tertiary carboxylic acid amides Heteroaromatic compounds Nitriles Azacyclic compounds Organic oxides Hydrocarbon derivatives Amines
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Pyrrolopyrazine - Aryl ketone - Aryl alkyl ketone - Aminopyrazine - 2,5-disubstituted thiophene - N-arylated-2-aminothiophene - Pyrazine - Substituted pyrrole - 2-aminothiophene - Imidolactam - Pyrrole - Tertiary carboxylic acid amide - Thiophene - Heteroaromatic compound - Vinylogous amide - Ketone - Carboxamide group - Nitrile - Carbonitrile - Carboxylic acid derivative - Azacycle - Organic nitrogen compound - Organic oxide - Cyanide - Amine - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrrolopyrazines. These are compounds containing a pyrrolopyrazine moiety, which consists of a pyrrole ring fused to a pyrazine. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Pyrazine is a 6-membered ring consisting of six carbon atoms and two nitrogen centers at ring positions 1 and 4.
External Descriptors
Not available