Compound Identification
SMILES
Br.COC1=CC=C(C=C1)N1C(SC=C1C1=CC=C(OC(F)F)C=C1)=NC1=NCCC1
InChIKey
InChIKey=CKXUXYYHPRYJTR-UHFFFAOYSA-N
Formula
C21H20BrF2N3O2S
Mass
496.37
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
Aniline and substituted anilines
- Level 5 Methoxyanilines
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Subclass
Aniline and substituted anilines
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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
Aniline and substituted anilines
Intermediate Tree Nodes
Not available
Direct Parent
Methoxyanilines
Alternative Parents
Phenoxy compounds Methoxybenzenes Anisoles Alkyl aryl ethers Thiazoles Pyrrolines Heteroaromatic compounds Isothioureas Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organonitrogen compounds Organofluorides Hydrocarbon derivatives Hydrobromides Alkyl fluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Methoxyaniline - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - Alkyl aryl ether - Azole - Pyrroline - Thiazole - Heteroaromatic compound - Isothiourea - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Azacycle - Organoheterocyclic compound - Ether - Alkyl halide - Organonitrogen compound - Organofluoride - Organohalogen compound - Organooxygen compound - Hydrocarbon derivative - Organic nitrogen compound - Alkyl fluoride - Hydrobromide - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as methoxyanilines. These are organic compound containing an aniline group substituted at one or more positions by a methoxy group.
External Descriptors
Not available