Compound Identification
SMILES
COCCNC1=CC=CC(=C1)C1=CC=C2C=NC(SC)=NN12.COCCNC1=CC=CC(=C1)C1=CC=C2C=NC(=NN12)S(C)=O
InChIKey
InChIKey=QNILYADRKSWDHC-UHFFFAOYSA-N
Formula
C32H36N8O3S2
Mass
644.81
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Pyrroles
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Subclass
Substituted pyrroles
- Level 5 Phenylpyrroles
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Subclass
Substituted pyrroles
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Class
Pyrroles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrroles
Subclass
Substituted pyrroles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrroles
Alternative Parents
Pyrrolo[2,1-f][1,2,4]triazines Phenylalkylamines Aniline and substituted anilines Secondary alkylarylamines Alkylarylthioethers 1,2,4-triazines Heteroaromatic compounds Sulfoxides Sulfinyl compounds Sulfenyl compounds Dialkyl ethers Azacyclic compounds Organopnictogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
2-phenylpyrrole - Pyrrolo[2,1-f][1,2,4]triazine - Aryl thioether - Phenylalkylamine - Aniline or substituted anilines - Secondary aliphatic/aromatic amine - Alkylarylthioether - Monocyclic benzene moiety - Triazine - Benzenoid - 1,2,4-triazine - Heteroaromatic compound - Sulfoxide - Dialkyl ether - Ether - Secondary amine - Thioether - Sulfinyl compound - Sulfenyl compound - Azacycle - Organopnictogen compound - Organic oxygen compound - Organosulfur compound - Organic nitrogen compound - Organic oxide - Amine - Hydrocarbon derivative - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrroles. These are polycyclic aromatic compounds containing a benzene ring linked to a pyrrole ring through a CC or CN bond.
External Descriptors
Not available