Compound Identification
SMILES
NC(=O)C1=CC2=C(O\C1=N/C1=C(C#N)C3=C(CCCC3)S1)C=CC(Br)=C2
InChIKey
InChIKey=SZBOTGMISSJUIA-NKFKGCMQSA-N
Formula
C19H14BrN3O2S
Mass
428.3
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Benzopyrans
- 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
Not available
Direct Parent
1-benzopyrans
Alternative Parents
Benzenoids Aryl bromides Thiophenes Heteroaromatic compounds Primary carboxylic acid amides Oxacyclic compounds Nitriles Organopnictogen compounds Organooxygen compounds Organobromides Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1-benzopyran - Aryl bromide - Aryl halide - Benzenoid - Thiophene - Heteroaromatic compound - Carboxamide group - Primary carboxylic acid amide - Nitrile - Carbonitrile - Carboxylic acid derivative - Oxacycle - Organic oxide - Organopnictogen compound - Organic nitrogen compound - Organooxygen compound - Organonitrogen compound - Organobromide - Organohalogen compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1-benzopyrans. These are organic aromatic compounds that 1-benzopyran, a bicyclic compound made up of a benzene ring fused to a pyran, so that the oxygen atom is at the 1-position.
External Descriptors
Not available