Structure Information
Structure

Compound Identification

SMILES

OC(=O)CNCP(O)(O)=O.OC(=O)C1=CC=CC=C1S(=O)(=O)NC(=O)NC1=NC(OC(F)F)=CC(OC(F)F)=N1.CCOC(=O)C(C)OC(=O)C1=C(C=CC(OC2=C(Cl)C=C(C=C2)C(F)(F)F)=C1)[N+]([O-])=O

InChIKey

InChIKey=IIVCYCGATPWOID-UHFFFAOYSA-N

Formula

C36H33ClF7N6O19PS

Mass

1085.16

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Taxonomic Classification

Taxonomy Tree

Kingdom

Organic compounds

Superclass

Organic nitrogen compounds

Class

Organonitrogen compounds

Subclass

Sulfonylureas

Intermediate Tree Nodes

Not available

Direct Parent

Pyrimidinyl-2-sulfonylureas

Alternative Parents

Molecular Framework

Not available

Substituents

Pyrimidinyl-2-sulfonylurea - Diphenylether - Nitrobenzoate - Diaryl ether - Alpha-amino acid or derivatives - Trifluoromethylbenzene - Benzoate ester - Benzenesulfonamide - Nitrobenzene - Benzenesulfonyl group - Benzoic acid - Benzoic acid or derivatives - Phenoxy compound - Nitroaromatic compound - Phenol ether - Benzoyl - Halobenzene - Chlorobenzene - Aryl chloride - Monocyclic benzene moiety - Benzenoid - Aryl halide - Pyrimidine - Organophosphonic acid - Heteroaromatic compound - Aminosulfonyl compound - Sulfonyl - Organophosphonic acid derivative - Organic sulfonic acid or derivatives - Organosulfonic acid or derivatives - Amino acid - C-nitro compound - Organic nitro compound - Carboxylic acid ester - Amino acid or derivatives - Azacycle - Organoheterocyclic compound - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Carboxylic acid derivative - Secondary amine - Carboxylic acid - Ether - Monocarboxylic acid or derivatives - Organic oxoazanium - Carbonyl group - Organic oxide - Amine - Hydrocarbon derivative - Alkyl fluoride - Organosulfur compound - Organophosphorus compound - Alkyl halide - Organooxygen compound - Organic salt - Organofluoride - Organochloride - Organic oxygen compound - Organohalogen compound - Organic cation - Aromatic heteromonocyclic compound

Description

This compound belongs to the class of organic compounds known as pyrimidinyl-2-sulfonylureas. These are aromatic heterocyclic compounds containing a pyrimidine ring which is substituted with a sulfonylurea at the ring 2-position.

External Descriptors

Not available

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