Compound Identification
SMILES
ClC1=CC=C(C=C1)C#CCOC1=NSN=C1C12CN3C[C@H]1[C@H]2C3
InChIKey
InChIKey=JVDFDVTZQWJMQV-VMZNBEPHSA-N
Formula
C17H14ClN3OS
Mass
343.83
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Halobenzenes
- 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
Not available
Direct Parent
Chlorobenzenes
Alternative Parents
Aralkylamines Alkyl aryl ethers Piperidines N-alkylpyrrolidines Aryl chlorides Thiadiazoles Heteroaromatic compounds Trialkylamines Azacyclic compounds Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alkyl aryl ether - Chlorobenzene - Aralkylamine - Aryl chloride - Aryl halide - Piperidine - N-alkylpyrrolidine - Heteroaromatic compound - Thiadiazole - Pyrrolidine - Azole - Tertiary aliphatic amine - Tertiary amine - Azacycle - Organoheterocyclic compound - Ether - Organic nitrogen compound - Organohalogen compound - Organochloride - Organic oxygen compound - Organonitrogen compound - Amine - Organooxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as chlorobenzenes. These are compounds containing one or more chlorine atoms attached to a benzene moiety.
External Descriptors
Not available