Compound Identification
SMILES
O=C(NCC1CCCO1)C1CCC(CN2C(=S)NC3=CC=CC=C3C2=O)CC1
InChIKey
InChIKey=OOFZCOFFHHWNQG-UHFFFAOYSA-N
Formula
C21H27N3O3S
Mass
401.53
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazanaphthalenes
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Subclass
Benzodiazines
- Level 5 Quinazolines
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Subclass
Benzodiazines
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Class
Diazanaphthalenes
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazanaphthalenes
Subclass
Benzodiazines
Intermediate Tree Nodes
Not available
Direct Parent
Quinazolines
Alternative Parents
Pyrimidones Pyrimidinethiones 2-Thiopyrimidines Benzenoids Vinylogous amides Oxolanes Heteroaromatic compounds Thioureas Secondary carboxylic acid amides Lactams Oxacyclic compounds Azacyclic compounds Dialkyl ethers Organopnictogen compounds Carbonyl compounds Organonitrogen compounds Hydrocarbon derivatives Organic oxides
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Quinazoline - 2-thiopyrimidine - Pyrimidinethione - Pyrimidone - Thiopyrimidine - Pyrimidine - Benzenoid - Oxolane - Vinylogous amide - Heteroaromatic compound - Carboxamide group - Thiourea - Secondary carboxylic acid amide - Lactam - Oxacycle - Azacycle - Carboxylic acid derivative - Dialkyl ether - Ether - Carbonyl group - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as quinazolines. These are compounds containing a quinazoline moiety, which is made up of two fused six-member aromatic rings, a benzene ring and a pyrimidine ring.
External Descriptors
Not available