Compound Identification
SMILES
CC(C)NC(=O)C1=CN=C(NC2=NC(NCCN(C)C)=NC(=N2)C2=CC=CC=C2)N1C
InChIKey
InChIKey=GLMYHPWCKKBBIH-UHFFFAOYSA-N
Formula
C21H29N9O
Mass
423.525
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
-
Subclass
Imidazoles
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Level 5
Substituted imidazoles
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Level 6
Trisubstituted imidazoles
- Level 7 1,2,5-trisubstituted imidazoles
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Level 6
Trisubstituted imidazoles
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Level 5
Substituted imidazoles
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Subclass
Imidazoles
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Class
Azoles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Imidazoles
Intermediate Tree Nodes
Substituted imidazoles - Trisubstituted imidazoles
Direct Parent
1,2,5-trisubstituted imidazoles
Alternative Parents
1,3,5-triazine-2,4-diamines 2-heteroaryl carboxamides Secondary alkylarylamines N-aliphatic s-triazines Carbonylimidazoles 1,3,5-triazines Aminoimidazoles N-substituted imidazoles Benzene and substituted derivatives Heteroaromatic compounds Amino acids and derivatives Secondary carboxylic acid amides Trialkylamines Azacyclic compounds Hydrocarbon derivatives Organic oxides Organooxygen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
2-heteroaryl carboxamide - 1,2,5-trisubstituted-imidazole - 2,4-diamine-s-triazine - Amino-1,3,5-triazine - Aminotriazine - Imidazole-4-carbonyl group - Secondary aliphatic/aromatic amine - N-aliphatic s-triazine - Aminoimidazole - Monocyclic benzene moiety - N-substituted imidazole - Triazine - Benzenoid - 1,3,5-triazine - Heteroaromatic compound - Secondary carboxylic acid amide - Tertiary aliphatic amine - Amino acid or derivatives - Carboxamide group - Tertiary amine - Secondary amine - Azacycle - Carboxylic acid derivative - Organic oxide - Amine - Hydrocarbon derivative - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as 1,2,5-trisubstituted imidazoles. These are imidazoles in which the imidazole ring is substituted at positions 1, 2, and 5.
External Descriptors
Not available