Compound Identification
SMILES
Cn1nc(c(Cc2c(O)n(CC=C)c(=S)[nH]c2=O)c1Cl)-c1ccc(cc1)[N+]([O-])=O
InChIKey
InChIKey=WCDFCXCFDUBXSY-UHFFFAOYSA-N
Formula
C18H16ClN5O4S
Mass
433.87
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Azoles
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Subclass
Pyrazoles
- Level 5 Phenylpyrazoles
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Subclass
Pyrazoles
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Class
Azoles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Pyrazoles
Intermediate Tree Nodes
Not available
Direct Parent
Phenylpyrazoles
Alternative Parents
Nitrobenzenes Nitroaromatic compounds Pyrimidones Pyrimidinethiones 2-Thiopyrimidines Hydroxypyrimidines Aryl chlorides Hydropyrimidines Vinylogous amides Vinylogous acids Heteroaromatic compounds Thioureas Lactams Propargyl-type 1,3-dipolar organic compounds Azacyclic compounds Organic oxoazanium compounds Organic zwitterions Organochlorides Hydrocarbon derivatives Organonitrogen compounds Organic salts Organooxygen compounds Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Phenylpyrazole - Nitrobenzene - Nitroaromatic compound - Pyrimidone - 2-thiopyrimidine - Pyrimidinethione - Thiopyrimidine - Hydroxypyrimidine - Aryl chloride - Aryl halide - Benzenoid - Pyrimidine - Monocyclic benzene moiety - Hydropyrimidine - Vinylogous acid - Vinylogous amide - Heteroaromatic compound - Thiourea - C-nitro compound - Organic nitro compound - Lactam - Azacycle - Organic 1,3-dipolar compound - Organic oxoazanium - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organonitrogen compound - Organochloride - Organic oxygen compound - Organohalogen compound - Organic nitrogen compound - Organic salt - Organooxygen compound - Organosulfur compound - Organic oxide - Hydrocarbon derivative - Organic zwitterion - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylpyrazoles. These are compounds containing a phenylpyrazole skeleton, which consists of a pyrazole bound to a phenyl group.
External Descriptors
Not available