Compound Identification
SMILES
C[C@@H](O)C1=CC(Cl)=C(OCCCC2=NC=C(S2)C2=C([C@H]3CC[C@@H](C2)N3)C(=O)N(CC2=C(Cl)C(Cl)=CC=C2)C2CC2)C(Cl)=C1
InChIKey
InChIKey=SMXKMWONFJHWAC-OWWOZPERSA-N
Formula
C32H33Cl4N3O3S
Mass
681.49
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
-
Subclass
Halobenzenes
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Level 5
Chlorobenzenes
- Level 6 Dichlorobenzenes
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Level 5
Chlorobenzenes
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Subclass
Halobenzenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Halobenzenes
Intermediate Tree Nodes
Chlorobenzenes
Direct Parent
Dichlorobenzenes
Alternative Parents
Phenol ethers Phenoxy compounds 2,5-disubstituted thiazoles Alkyl aryl ethers Aryl chlorides Heteroaromatic compounds Tertiary carboxylic acid amides Pyrrolidines Amino acids and derivatives Secondary alcohols Dialkylamines Azacyclic compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds Aromatic alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenoxy compound - 1,2-dichlorobenzene - 1,3-dichlorobenzene - Phenol ether - 2,5-disubstituted 1,3-thiazole - Alkyl aryl ether - Aryl chloride - Aryl halide - Azole - Heteroaromatic compound - Pyrrolidine - Tertiary carboxylic acid amide - Thiazole - Amino acid or derivatives - Secondary alcohol - Carboxamide group - Organoheterocyclic compound - Secondary amine - Carboxylic acid derivative - Ether - Azacycle - Secondary aliphatic amine - Aromatic alcohol - Alcohol - Organohalogen compound - Organochloride - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organonitrogen compound - Organooxygen compound - Amine - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as dichlorobenzenes. These are compounds containing a benzene with exactly two chlorine atoms attached to it.
External Descriptors
Not available