Compound Identification
SMILES
CC(C)(C)C(=O)C(OC1=CC=C(Cl)C=C1)N1C=NC=N1.CC(C)(C)C(O)(CCC1=CC=C(Cl)C=C1)CN1C=NC=N1
InChIKey
InChIKey=PJGMGVOZCWJQMY-UHFFFAOYSA-N
Formula
C30H38Cl2N6O3
Mass
601.57
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Phenylbutylamines
-
Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Phenylbutylamines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylbutylamines
Alternative Parents
Phenoxy compounds Phenol ethers Chlorobenzenes Aryl chlorides Triazoles Tertiary alcohols Heteroaromatic compounds Ketones Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
Phenylbutylamine - Phenoxy compound - Phenol ether - Halobenzene - Chlorobenzene - Aryl halide - Aryl chloride - Heteroaromatic compound - 1,2,4-triazole - Tertiary alcohol - Azole - Ketone - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Carbonyl group - Alcohol - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylbutylamines. These are compounds containing a phenylbutylamine moiety, which consists of a phenyl group substituted at the fourth carbon by an butan-1-amine.
External Descriptors
Not available