Compound Identification
SMILES
FC1=CN=C(C=C1)C(=O)CC1=CC(=C(F)C=C1)[C@]12COC[C@H]1CSC(NC(=O)C1=CC=CC=C1)=N2
InChIKey
InChIKey=IABFIJZXDMQCTF-QYBDOPJKSA-N
Formula
C26H21F2N3O3S
Mass
493.53
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzoic acids and derivatives
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Benzoic acids and derivatives
Alternative Parents
Aryl alkyl ketones Benzoyl derivatives Fluorobenzenes Pyridines and derivatives 1,3-thiazines Aryl fluorides Oxolanes Heteroaromatic compounds Isothioureas Propargyl-type 1,3-dipolar organic compounds Dialkyl ethers Carboxylic acids and derivatives Carboximidamides Azacyclic compounds Oxacyclic compounds Organic oxides Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Benzoic acid or derivatives - Benzoyl - Aryl alkyl ketone - Aryl ketone - Fluorobenzene - Halobenzene - Meta-thiazine - Aryl fluoride - Aryl halide - Pyridine - Heteroaromatic compound - Oxolane - Isothiourea - Ketone - Oxacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Carboximidamide - Hydrocarbon derivative - Organic nitrogen compound - Organic oxygen compound - Organohalogen compound - Organofluoride - Organonitrogen compound - Organooxygen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as benzoic acids and derivatives. These are organic compounds containing a carboxylic acid substituent attached to a benzene ring.
External Descriptors
Not available