Compound Identification
SMILES
O=C(NC1=CC=C(C=C1)N1CCOCC1)C1=NN=C(NC(=O)C2=CC=C(C=C2)C#N)O1
InChIKey
InChIKey=YXKSDAGDGVVXNJ-UHFFFAOYSA-N
Formula
C21H18N6O4
Mass
418.413
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
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Superclass
Benzenoids
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Class
Benzene and substituted derivatives
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Subclass
Anilides
- Level 5 Aromatic anilides
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Subclass
Anilides
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Class
Benzene and substituted derivatives
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Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Anilides
Intermediate Tree Nodes
Not available
Direct Parent
Aromatic anilides
Alternative Parents
Phenylmorpholines Benzamides 2-heteroaryl carboxamides Aniline and substituted anilines Dialkylarylamines Benzoyl derivatives Benzonitriles 1,3,4-oxadiazoles Heteroaromatic compounds Secondary carboxylic acid amides Amino acids and derivatives Oxacyclic compounds Nitriles Dialkyl ethers Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aromatic anilide - Phenylmorpholine - Benzamide - Benzoic acid or derivatives - 2-heteroaryl carboxamide - Benzonitrile - Benzoyl - Aniline or substituted anilines - Dialkylarylamine - Tertiary aliphatic/aromatic amine - Morpholine - Oxazinane - 1,3,4-oxadiazole - Azole - Heteroaromatic compound - Oxadiazole - Amino acid or derivatives - Carboxamide group - Tertiary amine - Secondary carboxylic acid amide - Organoheterocyclic compound - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Azacycle - Carbonitrile - Nitrile - Organic nitrogen compound - Amine - Organooxygen compound - Organic oxygen compound - Cyanide - Organic oxide - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aromatic anilides. These are aromatic compounds containing an anilide group in which the carboxamide group is substituted with an aromatic group. They have the general structure RNC(=O)R', where R= benzene, and R = aryl group.
External Descriptors
Not available