Compound Identification
SMILES
CC1NC2=C(C=C3C(OC4=C(C5=NC(C)C(C)(C)C5=CC4=C3C3=CC=C(C=C3)C(=O)NCCN3C4=C(C=C(Cl)C=C4)C(=NCC3=O)C3=CC=CC=C3F)S(O)(=O)=O)=C2S(O)(=O)=O)C1(C)C
InChIKey
InChIKey=VZYCJVBRCJNJRE-UHFFFAOYSA-N
Formula
C47H43ClFN5O9S2
Mass
940.46
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Benzopyrans
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Subclass
1-benzopyrans
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Level 5
Dibenzopyrans
- Level 6 Xanthenes
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Level 5
Dibenzopyrans
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Subclass
1-benzopyrans
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Class
Benzopyrans
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzopyrans
Subclass
1-benzopyrans
Intermediate Tree Nodes
Dibenzopyrans
Direct Parent
Xanthenes
Alternative Parents
1,4-benzodiazepines Diarylethers Alpha amino acids and derivatives Arylsulfonic acids and derivatives Benzamides Indolines Benzoyl derivatives Aralkylamines Secondary alkylarylamines Fluorobenzenes Aryl chlorides Aryl fluorides Tertiary carboxylic acid amides Sulfonyls Organosulfonic acids Secondary carboxylic acid amides Lactams Ketimines Azacyclic compounds Oxacyclic compounds Propargyl-type 1,3-dipolar organic compounds Organic oxides Carbonyl compounds Organochlorides Organofluorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Xanthene - Diaryl ether - Benzodiazepine - 1,4-benzodiazepine - Alpha-amino acid or derivatives - Arylsulfonic acid or derivatives - Benzamide - Indole or derivatives - Dihydroindole - Benzoic acid or derivatives - Benzoyl - Aralkylamine - Secondary aliphatic/aromatic amine - Fluorobenzene - Halobenzene - Monocyclic benzene moiety - Benzenoid - Aryl halide - Aryl fluoride - Aryl chloride - Tertiary carboxylic acid amide - Sulfonyl - Organosulfonic acid - Organosulfonic acid or derivatives - Organic sulfonic acid or derivatives - Lactam - Ketimine - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Oxacycle - Secondary amine - Azacycle - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Ether - Carboxylic acid derivative - Organosulfur compound - Carbonyl group - Amine - Organic nitrogen compound - Organic oxygen compound - Imine - Organohalogen compound - Hydrocarbon derivative - Organic oxide - Organochloride - Organofluoride - Organonitrogen compound - Organooxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as xanthenes. These are polycyclic aromatic compounds containing a xanthene moiety, which consists of two benzene rings joined to each other by a pyran ring.
External Descriptors
Not available