Compound Identification
SMILES
CN1C2CCN(CC3=NC=CN3)C2C(O)=NCC1CCC(O)=NC1=CC=CC=C1
InChIKey
InChIKey=AZIRORGNBKXBLU-UHFFFAOYSA-N
Formula
C21H28N6O2
Mass
396.495
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazepines
- Subclass 1,4-diazepines
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Class
Diazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazepines
Subclass
1,4-diazepines
Intermediate Tree Nodes
Not available
Direct Parent
1,4-diazepines
Alternative Parents
Aralkylamines N-alkylpyrrolidines Benzene and substituted derivatives Imidazoles Heteroaromatic compounds Cyclic carboximidic acids Trialkylamines Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organooxygen compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Para-diazepine - Aralkylamine - Monocyclic benzene moiety - N-alkylpyrrolidine - Benzenoid - Azole - Heteroaromatic compound - Imidazole - Cyclic carboximidic acid - Pyrrolidine - Tertiary amine - Tertiary aliphatic amine - Organic 1,3-dipolar compound - Azacycle - Carboximidic acid derivative - Carboximidic acid - Propargyl-type 1,3-dipolar organic compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Hydrocarbon derivative - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1,4-diazepines. These are organic compounds containing 1,4-diazepine, a seven-member heterocyclic ring with two nitrogen atoms in positions 1 and 4.
External Descriptors
Not available