Compound Identification
SMILES
COC1=CC=CC(=C1)C1=C(NC(=N1)C1=CC(=CC=C1)N(C)C)C(=O)NC1=NC=CS1
InChIKey
InChIKey=RLCGDZKTDBFFRR-UHFFFAOYSA-N
Formula
C22H21N5O2S
Mass
419.5
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
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Subclass
Imidazoles
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Level 5
Substituted imidazoles
- Level 6 Phenylimidazoles
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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
Direct Parent
Phenylimidazoles
Alternative Parents
2,4,5-trisubstituted imidazoles 2-heteroaryl carboxamides Aniline and substituted anilines Anisoles Dialkylarylamines Methoxybenzenes Phenoxy compounds Alkyl aryl ethers Carbonylimidazoles Heteroaromatic compounds Thiazoles Amino acids and derivatives Secondary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
4-phenylimidazole - 5-phenylimidazole - 2-phenylimidazole - 2-heteroaryl carboxamide - 2,4,5-trisubstituted-imidazole - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Trisubstituted imidazole - Alkyl aryl ether - Imidazole-4-carbonyl group - Monocyclic benzene moiety - Benzenoid - Heteroaromatic compound - Thiazole - Amino acid or derivatives - Carboxamide group - Tertiary amine - Secondary carboxylic acid amide - Ether - Carboxylic acid derivative - Azacycle - Organonitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organooxygen compound - Amine - Organic nitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylimidazoles. These are polycyclic aromatic compounds containing a benzene ring linked to an imidazole ring through a CC or CN bond.
External Descriptors
Not available