Compound Identification
SMILES
COC1=C(OC)C(NC2=CC=C(C=C2)C(N)=N)=C(F)C(CC2=NC(=O)N(N2)C2=C(SC=N2)C(O)=O)=C1
InChIKey
InChIKey=ZHPAQRIJANBXJI-UHFFFAOYSA-N
Formula
C22H20FN7O5S
Mass
513.5
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Methoxybenzenes
- Level 5 Dimethoxybenzenes
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Subclass
Methoxybenzenes
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Class
Benzene and substituted derivatives
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Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Methoxybenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Dimethoxybenzenes
Alternative Parents
Aminophenyl ethers Methoxyanilines Thiazolecarboxylic acids and derivatives Anisoles Phenoxy compounds 4,5-disubstituted thiazoles Alkyl aryl ethers Fluorobenzenes Primary aromatic amines Aryl fluorides Heteroaromatic compounds Triazoles Vinylogous amides Amino acids Carboxylic acids Carboximidamides Carboxamidines Azacyclic compounds Secondary amines Organofluorides Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
O-dimethoxybenzene - Dimethoxybenzene - Aminophenyl ether - Methoxyaniline - Phenoxy compound - Anisole - Phenol ether - Thiazolecarboxylic acid or derivatives - Aniline or substituted anilines - 4,5-disubstituted 1,3-thiazole - Alkyl aryl ether - Fluorobenzene - Halobenzene - Aryl fluoride - Aryl halide - Primary aromatic amine - 1,2,4-triazole - Thiazole - Heteroaromatic compound - Vinylogous amide - Azole - Amino acid or derivatives - Amino acid - Azacycle - Secondary amine - Amidine - Organoheterocyclic compound - Carboximidamide - Ether - Carboxylic acid - Carboxylic acid derivative - Carboxylic acid amidine - Organooxygen compound - Hydrocarbon derivative - Organic oxygen compound - Organic nitrogen compound - Organic oxide - Organohalogen compound - Amine - Organofluoride - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as dimethoxybenzenes. These are organic aromatic compounds containing a monocyclic benzene moiety carrying exactly two methoxy groups.
External Descriptors
Not available