Compound Identification
SMILES
COC1=C(OC)C=C2C(CC3=NN=CN3N=C2C2=CC=C(N)C=C2)=C1
InChIKey
InChIKey=GXZCMNAORQFJAG-UHFFFAOYSA-N
Formula
C18H17N5O2
Mass
335.367
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
Anisoles Aniline and substituted anilines Alkyl aryl ethers 1,2-diazepines Triazoles Heteroaromatic compounds Azacyclic compounds Primary amines Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Triazolo-ortho-diazepine - Anisole - Phenol ether - Aniline or substituted anilines - Ortho-diazepine - Alkyl aryl ether - Benzenoid - Monocyclic benzene moiety - Heteroaromatic compound - 1,2,4-triazole - Azole - Azacycle - Ether - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Primary amine - Organic nitrogen compound - Amine - Hydrocarbon derivative - 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