Compound Identification
SMILES
COC1=CC(OC)=C(Cl)C=C1CCC1(CC(=O)C(SC2=NC3=C(C=NN3)C(N)=N2)C(=O)O1)C1CCCC1
InChIKey
InChIKey=SBAUCNIOTGCAFD-UHFFFAOYSA-N
Formula
C25H28ClN5O5S
Mass
546.04
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
Pyrazolo[3,4-d]pyrimidines Phenoxy compounds Anisoles Alkyl aryl ethers Alkylarylthioethers Aminopyrimidines and derivatives Chlorobenzenes Delta valerolactones 1,3-dicarbonyl compounds Oxanes Aryl chlorides Imidolactams Pyrazoles Heteroaromatic compounds Cyclic ketones Carboxylic acid esters Amino acids and derivatives Monocarboxylic acids and derivatives Azacyclic compounds Oxacyclic compounds Sulfenyl compounds Organic oxides Organochlorides Primary amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
M-dimethoxybenzene - Dimethoxybenzene - Pyrazolo[3,4-d]pyrimidine - Pyrazolopyrimidine - Phenoxy compound - Aryl thioether - Anisole - Phenol ether - Alkyl aryl ether - Aminopyrimidine - Chlorobenzene - Delta valerolactone - Halobenzene - Delta_valerolactone - Alkylarylthioether - Aryl chloride - Aryl halide - Oxane - Imidolactam - Pyrimidine - 1,3-dicarbonyl compound - Pyrazole - Azole - Heteroaromatic compound - Cyclic ketone - Amino acid or derivatives - Carboxylic acid ester - Lactone - Ketone - Organoheterocyclic compound - Sulfenyl compound - Thioether - Carboxylic acid derivative - Monocarboxylic acid or derivatives - Azacycle - Oxacycle - Ether - Primary amine - Hydrocarbon derivative - Organohalogen compound - Organochloride - Carbonyl group - Organonitrogen compound - Amine - Organic nitrogen compound - Organic oxygen compound - Organic oxide - Organooxygen compound - Organosulfur compound - Aromatic heteropolycyclic 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