Compound Identification
SMILES
CCN(CCNS(C)(=O)=O)C1=CC(C)=C(C=C1)N1C(=O)NC2=NC=CN2C11N2N=C(N=C2C(C(=O)OC2C(C)CC(C)CC2C)=C1C#N)C1=CC=CC=C1C
InChIKey
InChIKey=WVUJBYUFGFRVBU-UHFFFAOYSA-N
Formula
C39H46N10O5S
Mass
766.92
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
Triazoles
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Level 5
Phenyltriazoles
- Level 6 Phenyl-1,2,4-triazoles
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Level 5
Phenyltriazoles
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Subclass
Triazoles
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Class
Azoles
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Azoles
Subclass
Triazoles
Intermediate Tree Nodes
Phenyltriazoles
Direct Parent
Phenyl-1,2,4-triazoles
Alternative Parents
Diaminotoluenes Aniline and substituted anilines Dialkylarylamines Triazinones Organosulfonamides N-substituted imidazoles 1,3,5-triazines Organic sulfonamides Heteroaromatic compounds Enoate esters Aminosulfonyl compounds Amino acids and derivatives Ureas Ortho amides Monocarboxylic acids and derivatives Azacyclic compounds Nitriles Carbonyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl-1,2,4-triazole - Diaminotoluene - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Aminotoluene - Toluene - Triazinone - Monocyclic benzene moiety - Triazine - N-substituted imidazole - Organosulfonic acid amide - Benzenoid - Organic sulfonic acid amide - 1,3,5-triazine - Organic sulfonic acid or derivatives - Enoate ester - Alpha,beta-unsaturated carboxylic ester - Imidazole - Sulfonyl - Heteroaromatic compound - Organosulfonic acid or derivatives - Aminosulfonyl compound - Amino acid or derivatives - Carboxylic acid ester - Ortho amide - Urea - Tertiary amine - Nitrile - Carbonitrile - Monocarboxylic acid or derivatives - Carboxylic acid derivative - Azacycle - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Cyanide - Organic oxygen compound - Amine - Organic oxide - Hydrocarbon derivative - Organic nitrogen compound - Carbonyl group - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenyl-1,2,4-triazoles. These are organic compounds containing a 1,2,4-triazole substituted by a phenyl group.
External Descriptors
Not available