Compound Identification
SMILES
COC1=CC=C(C=C1)C1=NC(C[NH+]2CCN(CC3=C(O)C=C(C)C(C)=C3)CC2)=CS1
InChIKey
InChIKey=BFKMANFCOHUDKZ-UHFFFAOYSA-O
Formula
C24H30N3O2S
Mass
424.58
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylmethylamines
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylmethylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylmethylamines
Alternative Parents
Anisoles Benzylamines Meta cresols Methoxybenzenes Para cresols Phenoxy compounds o-Xylenes 1-hydroxy-2-unsubstituted benzenoids Alkyl aryl ethers N-alkylpiperazines Aralkylamines 2,4-disubstituted thiazoles Heteroaromatic compounds Quaternary ammonium salts Trialkylamines Azacyclic compounds Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylmethylamine - Phenoxy compound - Phenol ether - P-cresol - O-xylene - Xylene - Anisole - Benzylamine - M-cresol - Methoxybenzene - 2,4-disubstituted 1,3-thiazole - Phenol - Aralkylamine - Alkyl aryl ether - N-alkylpiperazine - 1-hydroxy-2-unsubstituted benzenoid - 1,4-diazinane - Piperazine - Azole - Heteroaromatic compound - Thiazole - Quaternary ammonium salt - Tertiary aliphatic amine - Tertiary amine - Organoheterocyclic compound - Ether - Azacycle - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Hydrocarbon derivative - Organic cation - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylmethylamines. These are compounds containing a phenylmethtylamine moiety, which consists of a phenyl group substituted by an methanamine.
External Descriptors
Not available