Compound Identification
SMILES
COC1=C(OC)C=C(C=C1)C1CC(=NC2=NC=NN12)C1=CC=C(Br)S1
InChIKey
InChIKey=RWPNYYDMCYLYAR-UHFFFAOYSA-N
Formula
C17H15BrN4O2S
Mass
419.3
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
-
Subclass
Methoxybenzenes
- Level 5 Dimethoxybenzenes
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Subclass
Methoxybenzenes
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Methoxybenzenes
Intermediate Tree Nodes
Not available
Direct Parent
Dimethoxybenzenes
Alternative Parents
Triazolopyrimidines Phenoxy compounds Anisoles Alkyl aryl ethers 2,5-disubstituted thiophenes Pyrimidines and pyrimidine derivatives Aryl bromides Triazoles Heteroaromatic compounds Ketimines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organobromides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
O-dimethoxybenzene - Dimethoxybenzene - Triazolopyrimidine - Phenoxy compound - Anisole - Phenol ether - Alkyl aryl ether - 2,5-disubstituted thiophene - Aryl bromide - Pyrimidine - Aryl halide - Heteroaromatic compound - Azole - 1,2,4-triazole - Triazole - Thiophene - Ketimine - Azacycle - Organoheterocyclic compound - Ether - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Hydrocarbon derivative - Imine - Organic oxygen compound - Organohalogen compound - Organobromide - Organonitrogen compound - Organooxygen compound - Organic nitrogen 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