Compound Identification
SMILES
COC1=CC=CC2=C1C1=C(C=C(C=C1)[N+](C)(C)C(N)=S)C(O2)C1=CC=C(Br)S1
InChIKey
InChIKey=XAXXESUNBDXSPE-UHFFFAOYSA-O
Formula
C21H20BrN2O2S2
Mass
476.43
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
- Level 5 Dibenzopyrans
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Subclass
1-benzopyrans
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Class
Benzopyrans
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzopyrans
Subclass
1-benzopyrans
Intermediate Tree Nodes
Not available
Direct Parent
Dibenzopyrans
Alternative Parents
2-benzopyrans Anisoles Alkyl aryl ethers 2,5-disubstituted thiophenes Aryl bromides Heteroaromatic compounds Oxacyclic compounds Organosulfur compounds Organopnictogen compounds Organonitrogen compounds Organobromides Hydrocarbon derivatives Organic cations
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Dibenzopyran - 2-benzopyran - Anisole - Alkyl aryl ether - 2,5-disubstituted thiophene - Aryl bromide - Aryl halide - Benzenoid - Heteroaromatic compound - Thiophene - Ether - Oxacycle - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organic cation - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as dibenzopyrans. These are organic heterocyclic compounds with a structure containing a dibenzopyran moiety, made up of two benzene rings fused to a central pyran ring.
External Descriptors
Not available