Compound Identification
SMILES
CO[C@]12[C@@H]3[C@H](CN1C1=C([C@H]2COC(N)=O)C(=O)C2(OCCO2)C(CSC2=NN=CN2C)C1=O)N3C(C)=O
InChIKey
InChIKey=PTUGJCSZMWPCOX-ATIUCZJGSA-N
Formula
C22H26N6O8S
Mass
534.54
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
- Class Indoles and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Indoles and derivatives
Subclass
Not available
Intermediate Tree Nodes
Not available
Direct Parent
Indoles and derivatives
Alternative Parents
Pyrrolizines Alkylarylthioethers Cyclohexenones Ketals Piperazines Vinylogous amides Triazoles Tertiary carboxylic acid amides 1,3-dioxolanes Pyrrolines Pyrrolidines Acetamides Carbamate esters Heteroaromatic compounds Sulfenyl compounds Oxacyclic compounds Azacyclic compounds Aziridines Aldehydes Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Indole or derivatives - Aryl thioether - Pyrrolizine - Ketal - Cyclohexenone - Alkylarylthioether - 1,4-diazinane - Piperazine - Meta-dioxolane - Azole - Pyrrolidine - Pyrroline - Tertiary carboxylic acid amide - 1,2,4-triazole - Carbamic acid ester - Vinylogous amide - Acetamide - Heteroaromatic compound - Carboxamide group - Ketone - Aziridine - Oxacycle - Azacycle - Carboxylic acid derivative - Sulfenyl compound - Acetal - Thioether - Organic nitrogen compound - Organic oxygen compound - Organonitrogen compound - Organooxygen compound - Carbonyl group - Organosulfur compound - Hydrocarbon derivative - Organopnictogen compound - Aldehyde - Organic oxide - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as indoles and derivatives. These are organic compounds containing an indole, which is a bicyclic ring system made up of a six-membered benzene ring fused to a five-membered nitrogen-containing pyrrole ring.
External Descriptors
Not available