Compound Identification
SMILES
COC(=O)NC1=NC2=C(N1)C=C(C=C2)C(O)(C1=CC=CS1)C1=CC=CC=C1
InChIKey
InChIKey=CACYHSNXKUWRSQ-UHFFFAOYSA-N
Formula
C20H17N3O3S
Mass
379.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Benzimidazoles
- Subclass 2-benzimidazolylcarbamic acid esters
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Class
Benzimidazoles
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Benzimidazoles
Subclass
2-benzimidazolylcarbamic acid esters
Intermediate Tree Nodes
Not available
Direct Parent
2-benzimidazolylcarbamic acid esters
Alternative Parents
Benzene and substituted derivatives Thiophenes Tertiary alcohols Imidazoles Heteroaromatic compounds Carbamate esters Azacyclic compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds Aromatic alcohols
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-benzimidazolylcarbamic acid ester - Monocyclic benzene moiety - Benzenoid - Azole - Imidazole - Tertiary alcohol - Thiophene - Carbamic acid ester - Heteroaromatic compound - Azacycle - Carbonyl group - Organic nitrogen compound - Alcohol - Organooxygen compound - Organonitrogen compound - Aromatic alcohol - Organic oxygen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 2-benzimidazolylcarbamic acid esters. These are aromatic heteropolycyclic compounds that contain a carbamic acid ester group, which is N-linked to the C2-atom of a benzimidazole moiety.
External Descriptors
Not available