Compound Identification
SMILES
COC1=C(Cl)C=C(C=C1)N1N=C2C=CC(NC(=S)NC(=O)C3=CC=C(O3)C3=CC(C)=C(C)C=C3)=CC2=N1
InChIKey
InChIKey=XXWUQFLTTKVWIZ-UHFFFAOYSA-N
Formula
C27H22ClN5O3S
Mass
532.02
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-1,2,3-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-1,2,3-triazoles
Alternative Parents
Benzotriazoles Methoxyanilines o-Xylenes Phenoxy compounds Anisoles Methoxybenzenes Furoic acid and derivatives Alkyl aryl ethers Chlorobenzenes Aryl chlorides Heteroaromatic compounds Thioureas Oxacyclic compounds Azacyclic compounds Carboxylic acids and derivatives Organochlorides Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Phenyl-1,2,3-triazole - Benzotriazole - Methoxyaniline - Anisole - Furoic acid or derivatives - Phenoxy compound - Phenol ether - O-xylene - Xylene - Methoxybenzene - Alkyl aryl ether - Chlorobenzene - Halobenzene - Benzenoid - Aryl chloride - Aryl halide - Monocyclic benzene moiety - Heteroaromatic compound - Furan - Thiourea - Oxacycle - Azacycle - Carboxylic acid derivative - Ether - Hydrocarbon derivative - Organohalogen compound - Organic nitrogen compound - Organochloride - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organopnictogen compound - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as phenyl-1,2,3-triazoles. These are organic compounds containing a 1,2,3-triazole substituted by a phenyl group.
External Descriptors
Not available