Compound Identification
SMILES
COC(=O)NC1=NC2=C(C=CC(SC3=CC=C(NC(=O)NC4=CC(Cl)=C(Cl)C=C4)C=C3)=C2)N1C(=O)NC1=CC=CC=C1
InChIKey
InChIKey=PNJNULWFMIQYJX-UHFFFAOYSA-N
Formula
C29H22Cl2N6O4S
Mass
621.49
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Benzimidazoles
- Subclass 2-benzimidazolylcarbamic acid esters
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Class
Benzimidazoles
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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
Diarylthioethers N-phenylureas Thiophenol ethers Dichlorobenzenes Carbonylimidazoles Aryl chlorides N-substituted imidazoles Carbamate esters Heteroaromatic compounds Ureas Sulfenyl compounds Azacyclic compounds Hydrocarbon derivatives Carbonyl compounds Organic oxides Organochlorides Organonitrogen compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-benzimidazolylcarbamic acid ester - Diarylthioether - N-phenylurea - 1,2-dichlorobenzene - Thiophenol ether - Aryl thioether - Imidazole-1-carbonyl group - Chlorobenzene - Halobenzene - Aryl halide - Benzenoid - Monocyclic benzene moiety - Aryl chloride - N-substituted imidazole - Heteroaromatic compound - Azole - Carbamic acid ester - Imidazole - Urea - Thioether - Sulfenyl compound - Azacycle - Organohalogen compound - Organonitrogen compound - Organic nitrogen compound - Organooxygen compound - Organosulfur compound - Organic oxygen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organochloride - 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