Compound Identification
SMILES
COC1=CC=CC=C1NC(=O)SCCCN1CCN(CC2=CC=CC=C2Cl)CC1
InChIKey
InChIKey=RWCOCBFPSFEYCV-UHFFFAOYSA-N
Formula
C22H28ClN3O2S
Mass
434.0
Taxonomic Classification
Taxonomy Tree
-
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
Anisoles Benzylamines Methoxybenzenes Phenoxy compounds Phenylmethylamines N-alkylpiperazines Aralkylamines Chlorobenzenes Alkyl aryl ethers Aryl chlorides Thiocarbamic acid derivatives Trialkylamines Azacyclic compounds Sulfenyl compounds Organochlorides Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Methoxyaniline - Anisole - Phenoxy compound - Benzylamine - Phenol ether - Phenylmethylamine - Methoxybenzene - Alkyl aryl ether - Chlorobenzene - Halobenzene - N-alkylpiperazine - Aralkylamine - Piperazine - Aryl chloride - Aryl halide - 1,4-diazinane - Tertiary aliphatic amine - Thiocarbamic acid derivative - Tertiary amine - Azacycle - Organoheterocyclic compound - Sulfenyl compound - Ether - Hydrocarbon derivative - Organic nitrogen compound - Organohalogen compound - Organochloride - Amine - Carbonyl group - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxide - 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