Compound Identification
SMILES
CCC(C)(C)C1=CC(=C(OCCCCNC(=O)C2=CC(=C3NN=C(SC(=O)NC4=CC=C(NNC=O)C=C4)S3)C3=CC=CC=C3C2=O)C=C1)C(C)(C)CC
InChIKey
InChIKey=BRLLBCRCIWNRPR-UHFFFAOYSA-N
Formula
C41H48N6O5S2
Mass
768.99
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Naphthalenes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Naphthalenes
Subclass
Naphthalenecarboxylic acids and derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Naphthalenecarboxylic acids and derivatives
Alternative Parents
Phenylpropanes Aryl ketones Phenol ethers Phenylhydrazines Phenoxy compounds Alkyl aryl ethers Thiadiazolines Thiocarbamic acid derivatives Carboxylic acid hydrazides Ketene acetals Secondary carboxylic acid amides Hydrazones Azacyclic compounds Sulfenyl compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
2-naphthalenecarboxylic acid or derivatives - Phenylpropane - Phenol ether - Phenylhydrazine - Phenoxy compound - Aryl ketone - Alkyl aryl ether - Monocyclic benzene moiety - Thiadiazoline - Carboxamide group - Carboxylic acid hydrazide - Ketene acetal or derivatives - Ketone - Secondary carboxylic acid amide - Thiocarbamic acid derivative - Azacycle - Hydrazone - Ether - Organoheterocyclic compound - Sulfenyl compound - Carboxylic acid derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Carbonyl group - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as naphthalenecarboxylic acids and derivatives. These are compounds containing a naphthalene moiety, which bears a carboxylic acid group or a derivative at one or more positions. Naphthalene is a bicyclic compound that is made up of two fused benzene ring.
External Descriptors
Not available