Compound Identification
SMILES
NC1=C(Nc2cccc(CNC(=O)c3cc(C(=O)N[C@H]4CCc5cc(ccc45)-c4nn[nH]n4)n4c(noc4=S)n3)c2)C(=O)C1=O
InChIKey
InChIKey=XDLKRJIMIBKUKB-KRWDZBQOSA-N
Formula
C28H21N11O5S
Mass
623.61
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Benzenoids
- Class Indanes
-
Superclass
Benzenoids
Kingdom
Organic compounds
Superclass
Benzenoids
Class
Indanes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Indanes
Alternative Parents
Pyrimidinecarboxylic acids and derivatives 2-heteroaryl carboxamides Aniline and substituted anilines Primary aromatic amines Vinylogous amides Tetrazoles 1,2,4-oxadiazoles Heteroaromatic compounds Secondary carboxylic acid amides Amino acids and derivatives Cyclic ketones Secondary amines Oxacyclic compounds Azacyclic compounds Organic oxides Organosulfur compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indane - Pyrimidine-6-carboxylic acid or derivatives - 2-heteroaryl carboxamide - Aniline or substituted anilines - Monocyclic benzene moiety - Primary aromatic amine - Pyrimidine - Heteroaromatic compound - Azole - 1,2,4-oxadiazole - Vinylogous amide - Oxadiazole - Tetrazole - Carboxamide group - Cyclic ketone - Amino acid or derivatives - Secondary carboxylic acid amide - Azacycle - Carboxylic acid derivative - Organoheterocyclic compound - Oxacycle - Secondary amine - Amine - Primary amine - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indanes. These are compounds containing an indane moiety, which consists of a cyclopentane fused to a benzene ring.
External Descriptors
Not available