Compound Identification
SMILES
CN(C)CCNC(=O)C1=NC(NC(=O)C2=NC(NC(=O)C3=C4N=NN(C)C(=O)N4C=N3)=CN2C)=CN1C
InChIKey
InChIKey=QXZGINCWNRKXPE-UHFFFAOYSA-N
Formula
C20H25N13O4
Mass
511.507
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Imidazotetrazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Imidazotetrazines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Imidazotetrazines
Alternative Parents
2-heteroaryl carboxamides 1,2,4-trisubstituted imidazoles Carbonylimidazoles Tetrazines N-substituted imidazoles Imidolactams Vinylogous amides Heteroaromatic compounds Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Imidazotetrazine - 2-heteroaryl carboxamide - 1,2,4-trisubstituted-imidazole - Trisubstituted imidazole - Imidazole-4-carbonyl group - Imidolactam - N-substituted imidazole - Tetrazine - Azole - Imidazole - Heteroaromatic compound - Vinylogous amide - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Secondary carboxylic acid amide - Tertiary amine - Azacycle - Carboxylic acid derivative - Hydrocarbon derivative - Amine - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as imidazotetrazines. These are organic polycyclic compounds containing an imidazole ring fused to a tetrazine ring. Imidazole is 5-membered ring consisting of three carbon atoms, and two nitrogen centers at the 1- and 3-positions. Tetrazine is a six-membered aromatic heterocycle made up of four nitrogen atoms and a two carbon atoms.
External Descriptors
Not available