Compound Identification
SMILES
NC1=C(C=NCC2=CC=CC=C2)C=CC(=C1)C1=C2N(N=CN=C2N)C(=C1)C1=CSC(=N1)C1CCNCC1
InChIKey
InChIKey=SEGXXXOVOKOZFF-UHFFFAOYSA-N
Formula
C28H28N8S
Mass
508.65
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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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 Aniline and substituted anilines Aralkylamines 2,4-disubstituted thiazoles Piperidines Imidolactams 1,2,4-triazines Heteroaromatic compounds Shiff bases Propargyl-type 1,3-dipolar organic compounds Dialkylamines Azacyclic compounds Primary amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
3-phenylpyrrole - Pyrrolo[2,1-f][1,2,4]triazine - Aniline or substituted anilines - 2,4-disubstituted 1,3-thiazole - Aralkylamine - Monocyclic benzene moiety - Piperidine - 1,2,4-triazine - Imidolactam - Triazine - Benzenoid - Azole - Heteroaromatic compound - Thiazole - Shiff base - Secondary amine - Azacycle - Aldimine - Secondary aliphatic amine - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Primary amine - Organonitrogen compound - Imine - Hydrocarbon derivative - Organic nitrogen compound - Amine - 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