Compound Identification
SMILES
COC(=O)NC1=NC2=CC=CC=C2N1.ClC(Cl)C(Cl)(Cl)SN1C(=O)C2CC=CCC2C1=O.CC(C)(C)C(=O)C(OC1=CC=C(Cl)C=C1)N1C=NC=N1
InChIKey
InChIKey=QRLULYOZBVMKIO-UHFFFAOYSA-N
Formula
C33H34Cl5N7O6S
Mass
833.99
Taxonomic Classification
Taxonomy Tree
-
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
Isoindoles Phenoxy compounds Phenol ethers Chlorobenzenes Aryl chlorides Triazoles Imidazoles Heteroaromatic compounds Carbamate esters Organic carbonic acids and derivatives Ketones Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organochlorides Organic oxides Hydrocarbon derivatives
Molecular Framework
Not available
Substituents
2-benzimidazolylcarbamic acid ester - Isoindole - Phenoxy compound - Phenol ether - Halobenzene - Chlorobenzene - Benzenoid - Monocyclic benzene moiety - Aryl halide - Aryl chloride - Heteroaromatic compound - Carbamic acid ester - 1,2,4-triazole - Imidazole - Azole - Carbonic acid derivative - Ketone - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Organonitrogen compound - Organochloride - Organohalogen compound - Carbonyl group - 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