Compound Identification
SMILES
CCOC(=O)C1=NN(C2=CC=C(C)C=C2)C2(C=C(N(C)CCN12)C1=CC=CC=C1)C1=CC=CC=C1
InChIKey
InChIKey=RMCQZPKWOCRAEJ-UHFFFAOYSA-N
Formula
C29H30N4O2
Mass
466.585
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Triazolodiazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Triazolodiazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Triazolodiazepines
Alternative Parents
Alpha amino acids and derivatives Toluenes 1,4-diazepines Imidolactams Triazolines Trialkylamines Amidrazones Carboxylic acid esters Amidines Monocarboxylic acids and derivatives Azacyclic compounds Enamines Hydrazones Carbonyl compounds Hydrocarbon derivatives Organic oxides Organopnictogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Alpha-amino acid or derivatives - Triazolo-para-diazepine - Para-diazepine - Toluene - Monocyclic benzene moiety - Benzenoid - Imidolactam - Triazoline - Carboxylic acid amidrazone - Amino acid or derivatives - Carboxylic acid ester - Tertiary amine - Tertiary aliphatic amine - Monocarboxylic acid or derivatives - Hydrazone - Enamine - Azacycle - Carboxylic acid derivative - Amidine - Organooxygen compound - Organonitrogen compound - Carbonyl group - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Amine - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as triazolodiazepines. These are heterocyclic aromatic compounds containing a triazole ring fused to a diazepine ring. Triazole is a five-membered ring consisting of two carbon atoms and three nitrogen atoms. Diazepine is a 7-membered ring consisting of five carbon and two nitrogen atoms.
External Descriptors
Not available