Compound Identification
SMILES
COC1=C(NC2=NC3=C(S2)C=CC2=C3N=CN2C)C=C(C=C1C)C(N)=O
InChIKey
InChIKey=BQPXKTLXJXERTA-UHFFFAOYSA-N
Formula
C18H17N5O2S
Mass
367.43
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
-
Class
Benzene and substituted derivatives
- Subclass Benzoic acids and derivatives
-
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
m-Toluamides Methoxyanilines Benzamides Benzothiazoles Benzimidazoles Phenoxy compounds Methoxybenzenes Anisoles Benzoyl derivatives Alkyl aryl ethers 2-amino-1,3-thiazoles N-substituted imidazoles Heteroaromatic compounds Primary carboxylic acid amides Azacyclic compounds Hydrocarbon derivatives Amines Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Aminobenzoic acid or derivatives - Benzamide - Benzimidazole - 1,3-benzothiazole - M-toluamide - Toluamide - Methoxyaniline - Anisole - Phenoxy compound - Benzoyl - Phenol ether - Aniline or substituted anilines - Methoxybenzene - Toluene - Alkyl aryl ether - N-substituted imidazole - 1,3-thiazol-2-amine - Thiazole - Heteroaromatic compound - Imidazole - Azole - Primary carboxylic acid amide - Carboxamide group - Organoheterocyclic compound - Azacycle - Ether - Carboxylic acid derivative - Organooxygen compound - Organic oxygen compound - Amine - Hydrocarbon derivative - Organic oxide - Organic nitrogen compound - Organonitrogen compound - Aromatic heteropolycyclic 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