Compound Identification
SMILES
CC(C)OC1=C(NC2=NC(=CS2)C2=C(C)N=C(S2)C(=O)N2CCCN(CC2)C(C)C)C=C(C=C1)C(N)=O
InChIKey
InChIKey=VHNHFEZOTGTYRV-UHFFFAOYSA-N
Formula
C26H34N6O3S2
Mass
542.72
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzoic acids and derivatives
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Class
Benzene and substituted derivatives
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Benzene and substituted derivatives
Subclass
Benzoic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Aminobenzoic acids and derivatives
Alternative Parents
Benzamides 2,4,5-trisubstituted thiazoles 2-heteroaryl carboxamides Aniline and substituted anilines Benzoyl derivatives Phenol ethers Phenoxy compounds Thiazolecarboxamides 2,4-disubstituted thiazoles 1,4-diazepanes Alkyl aryl ethers 2-amino-1,3-thiazoles Heteroaromatic compounds Tertiary carboxylic acid amides Trialkylamines Primary carboxylic acid amides Amino acids and derivatives Azacyclic compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
Aminobenzoic acid or derivatives - Benzamide - 2-heteroaryl carboxamide - Phenoxy compound - 2,4,5-trisubstituted 1,3-thiazole - Benzoyl - Aniline or substituted anilines - Phenol ether - Thiazolecarboxamide - Thiazolecarboxylic acid or derivatives - 1,4-diazepane - 2,4-disubstituted 1,3-thiazole - Alkyl aryl ether - Diazepane - 1,3-thiazol-2-amine - Tertiary carboxylic acid amide - Thiazole - Heteroaromatic compound - Azole - Tertiary amine - Primary carboxylic acid amide - Tertiary aliphatic amine - Amino acid or derivatives - Carboxamide group - Ether - Organoheterocyclic compound - Carboxylic acid derivative - Azacycle - Organooxygen compound - Organic nitrogen compound - Organonitrogen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as aminobenzoic acids and derivatives. These are benzoic acids (or derivative thereof) containing an amine group attached to the benzene moiety.
External Descriptors
Not available