Compound Identification
SMILES
CN1C\C(=C/C2=CC=CC=C2)C2=C(C1)C(N1CCSC1=N2)C1=CC=CC=C1
InChIKey
InChIKey=KIFXCSNEPWRPBA-XMHGGMMESA-N
Formula
C23H23N3S
Mass
373.52
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
-
Class
Diazines
-
Subclass
Pyrimidines and pyrimidine derivatives
- Level 5 Hydropyrimidines
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Subclass
Pyrimidines and pyrimidine derivatives
-
Class
Diazines
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Diazines
Subclass
Pyrimidines and pyrimidine derivatives
Intermediate Tree Nodes
Not available
Direct Parent
Hydropyrimidines
Alternative Parents
Benzene and substituted derivatives Thiazolidines Trialkylamines Isothioureas Propargyl-type 1,3-dipolar organic compounds Carboximidamides Azacyclic compounds Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
Monocyclic benzene moiety - Hydropyrimidine - 1,6-dihydropyrimidine - Benzenoid - Thiazolidine - Tertiary aliphatic amine - Tertiary amine - Isothiourea - Organic 1,3-dipolar compound - Carboximidamide - Azacycle - Propargyl-type 1,3-dipolar organic compound - Amine - Organonitrogen compound - Hydrocarbon derivative - Organic nitrogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as hydropyrimidines. These are compounds containing a hydrogenated pyrimidine ring (i.e. containing less than the maximum number of double bonds.).
External Descriptors
Not available