Compound Identification
SMILES
OC(=O)C(F)(F)F.O=C1CCCN1CC1CN(CC2CCOCC2)Cc2nccn2C1
InChIKey
InChIKey=MBUMHCZCUIYPCI-UHFFFAOYSA-N
Formula
C20H29F3N4O4
Mass
446.471
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Imidazodiazepines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Imidazodiazepines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Imidazodiazepines
Alternative Parents
Aralkylamines Pyrrolidine-2-ones Oxanes N-substituted imidazoles N-alkylpyrrolidines Tertiary carboxylic acid amides Alpha-halocarboxylic acids Heteroaromatic compounds Trialkylamines Amino acids and derivatives Lactams Oxacyclic compounds Monocarboxylic acids and derivatives Azacyclic compounds Dialkyl ethers Carboxylic acids Carbonyl compounds Hydrocarbon derivatives Organic oxides Organofluorides Organopnictogen compounds Alkyl fluorides
Molecular Framework
Not available
Substituents
Imidazodiazepine - Imidazo-para-diazepine - Aralkylamine - N-substituted imidazole - Oxane - Pyrrolidone - 2-pyrrolidone - N-alkylpyrrolidine - Alpha-halocarboxylic acid - Pyrrolidine - Tertiary carboxylic acid amide - Imidazole - Alpha-halocarboxylic acid or derivatives - Heteroaromatic compound - Azole - Tertiary aliphatic amine - Tertiary amine - Lactam - Amino acid or derivatives - Carboxamide group - Carboxylic acid derivative - Carboxylic acid - Dialkyl ether - Ether - Oxacycle - Azacycle - Monocarboxylic acid or derivatives - Organic oxygen compound - Organic nitrogen compound - Alkyl halide - Alkyl fluoride - Hydrocarbon derivative - Carbonyl group - Organic oxide - Amine - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as imidazodiazepines. These are organic compounds containing an imidazole ring fused to a diazepine ring. Imidazole is 5-membered ring consisting of three carbon atoms, and two nitrogen centers at the 1- and 3-positions. Diazepine is a 7-membered ring consisting of five carbon and two nitrogen atoms.
External Descriptors
Not available