Compound Identification
SMILES
ClC1=CC=C(COC2=NN=C(N3C=CN=C23)S(=O)CC2=CC=C(Cl)C=C2)C=C1
InChIKey
InChIKey=VLYCDXJZJNETTQ-UHFFFAOYSA-N
Formula
C19H14Cl2N4O2S
Mass
433.31
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzyl sulfoxides
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzyl sulfoxides
Intermediate Tree Nodes
Not available
Direct Parent
Benzyl sulfoxides
Alternative Parents
Imidazo[1,2-d][1,2,4]triazines Chlorobenzenes Alkyl aryl ethers N-substituted imidazoles Aryl chlorides 1,2,4-triazines Heteroaromatic compounds Sulfoxides Sulfinyl compounds Azacyclic compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzyl sulfoxide - Imidazo[1,2-d][1,2,4]triazine - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - N-substituted imidazole - 1,2,4-triazine - Triazine - Azole - Heteroaromatic compound - Imidazole - Sulfoxide - Azacycle - Ether - Organoheterocyclic compound - Sulfinyl compound - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Organic oxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzyl sulfoxides. These are organosulfur compounds that contain a sulfoxide group substituted by a benzyl group. They have the general structure RS(=O)R' ( R=benzyl, R'=organyl).
External Descriptors
Not available