Compound Identification
SMILES
CN1CCN(CCCNC2=NC=NC3=C2C=NN3C2=CC=C(OCCCC3=C(N=C(S3)N3CCC4=CC=CC(C(=O)NC5=NC6=CC=CC=C6S5)=C4C3)C(O)=O)C=C2)CC1
InChIKey
InChIKey=UYKNWWODISPUHU-UHFFFAOYSA-N
Formula
C43H45N11O4S2
Mass
844.03
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
Tetrahydroisoquinolines Pyrazolo[3,4-d]pyrimidines Benzothiazoles 2,4,5-trisubstituted thiazoles Thiazolecarboxylic acids and derivatives Phenoxy compounds Phenol ethers Dialkylarylamines Alkyl aryl ethers Secondary alkylarylamines Aminopyrimidines and derivatives N-methylpiperazines 2-amino-1,3-thiazoles Imidolactams Heteroaromatic compounds Trialkylamines Amino acids Secondary carboxylic acid amides Carboxylic acids Azacyclic compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenylpyrazole - Tetrahydroisoquinoline - Pyrazolo[3,4-d]pyrimidine - Pyrazolopyrimidine - 1,3-benzothiazole - 2,4,5-trisubstituted 1,3-thiazole - Phenoxy compound - Phenol ether - Thiazolecarboxylic acid or derivatives - Dialkylarylamine - Alkyl aryl ether - Secondary aliphatic/aromatic amine - Aminopyrimidine - N-methylpiperazine - N-alkylpiperazine - Monocyclic benzene moiety - 1,4-diazinane - Pyrimidine - Piperazine - Benzenoid - Imidolactam - 1,3-thiazol-2-amine - Thiazole - Heteroaromatic compound - Tertiary aliphatic amine - Tertiary amine - Secondary carboxylic acid amide - Carboxamide group - Amino acid - Amino acid or derivatives - Azacycle - Secondary amine - Carboxylic acid derivative - Carboxylic acid - Ether - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Amine - Organic oxide - Organonitrogen compound - Hydrocarbon derivative - Aromatic heteropolycyclic 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