Compound Identification
SMILES
CCOC(=O)C1=C(NC(=O)C(C)SC2=NN=C(CNC(=O)C3=CC(=C(C)C=C3)[N+]([O-])=O)N2C)SC2=C1CCCCC2
InChIKey
InChIKey=KEGVOUAPTHSMTB-UHFFFAOYSA-N
Formula
C27H32N6O6S2
Mass
600.71
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Cycloheptathiophenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Cycloheptathiophenes
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Cycloheptathiophenes
Alternative Parents
p-Toluamides Benzamides Nitrobenzenes Nitrotoluenes Thiophene carboxylic acids and derivatives Benzoyl derivatives N-arylamides Nitroaromatic compounds Alkylarylthioethers Vinylogous amides Triazoles Heteroaromatic compounds Secondary carboxylic acid amides Carboxylic acid esters Azacyclic compounds Propargyl-type 1,3-dipolar organic compounds Sulfenyl compounds Organic oxoazanium compounds Organic salts Hydrocarbon derivatives Organic zwitterions Carbonyl compounds Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Cycloheptathiophene - Benzamide - Benzoic acid or derivatives - P-toluamide - Toluamide - Nitrobenzene - Nitrotoluene - Aryl thioether - Nitroaromatic compound - Benzoyl - Thiophene carboxylic acid or derivatives - N-arylamide - Toluene - Alkylarylthioether - Monocyclic benzene moiety - Benzenoid - Azole - Heteroaromatic compound - Thiophene - Vinylogous amide - 1,2,4-triazole - Carboxamide group - Carboxylic acid ester - C-nitro compound - Secondary carboxylic acid amide - Organic nitro compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic 1,3-dipolar compound - Sulfenyl compound - Carboxylic acid derivative - Azacycle - Organic oxoazanium - Thioether - Organic oxide - Organic salt - Organic oxygen compound - Hydrocarbon derivative - Carbonyl group - Organonitrogen compound - Organooxygen compound - Organosulfur compound - Organic nitrogen compound - Organic zwitterion - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as cycloheptathiophenes. These are polycyclic compounds containing a thiophene ring fused to a 7 member carbocyclic moiety. Thiophene is 5-membered ring consisting of four carbon atoms and one sulfur atom.
External Descriptors
Not available