Compound Identification
SMILES
COC1=C(C=C(C=C1C(C)(C)C)C1=NC=C(S1)C1CCN(CC1)C(=O)CN1C=CC2=C1N=CC=C2)C(C)(C)C
InChIKey
InChIKey=IQYACPWVJRYRGA-UHFFFAOYSA-N
Formula
C32H40N4O2S
Mass
544.76
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Pyrrolopyridines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Pyrrolopyridines
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Pyrrolopyridines
Alternative Parents
N-acylpiperidines Phenylpropanes Anisoles Methoxybenzenes Phenoxy compounds Alkyl aryl ethers 2,5-disubstituted thiazoles Pyridines and derivatives Substituted pyrroles Tertiary carboxylic acid amides Heteroaromatic compounds Amino acids and derivatives Tertiary amines Azacyclic compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
N-acyl-piperidine - Phenylpropane - Pyrrolopyridine - Phenoxy compound - Anisole - Phenol ether - Methoxybenzene - 2,5-disubstituted 1,3-thiazole - Alkyl aryl ether - Monocyclic benzene moiety - Piperidine - Pyridine - Benzenoid - Substituted pyrrole - Pyrrole - Thiazole - Tertiary carboxylic acid amide - Heteroaromatic compound - Azole - Tertiary amine - Amino acid or derivatives - Carboxamide group - Azacycle - Carboxylic acid derivative - Ether - Carbonyl group - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Organic oxide - Hydrocarbon derivative - Organic oxygen compound - Amine - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as pyrrolopyridines. These are compounds containing a pyrrolopyridine moiety, which consists of a pyrrole ring fused to a pyridine. Pyrrole is 5-membered ring consisting of four carbon atoms and one nitrogen atom. Pyridine is a 6-membered ring consisting of five carbon atoms and one nitrogen center.
External Descriptors
Not available