Compound Identification
SMILES
CN=S1(=O)CCN(CC1)C1=C(F)C=C(C=C1)N1C[C@H](CNC(=S)C(F)F)OC1=O
InChIKey
InChIKey=MNNRJCJQXLYDQR-LBPRGKRZSA-N
Formula
C17H21F3N4O3S2
Mass
450.5
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Organoheterocyclic compounds
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Class
Thiazinanes
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Subclass
Thiomorpholines
- Level 5 Phenylthiomorpholines
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Subclass
Thiomorpholines
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Class
Thiazinanes
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Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Thiazinanes
Subclass
Thiomorpholines
Intermediate Tree Nodes
Not available
Direct Parent
Phenylthiomorpholines
Alternative Parents
Aniline and substituted anilines Dialkylarylamines Fluorobenzenes Aryl fluorides Oxazolidinones Carbamate esters Carbo-azosulfones Thioamides Oxacyclic compounds Thiocarboxylic acid amides Azacyclic compounds Thiocarbonyl compounds Carbonyl compounds Alkyl fluorides Hydrocarbon derivatives Organic oxides Organofluorides
Molecular Framework
Aromatic heteromonocyclic compounds
Substituents
4-phenylthiomorpholine - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Fluorobenzene - Halobenzene - Benzenoid - Aryl fluoride - Aryl halide - Monocyclic benzene moiety - Oxazolidinone - Carbo-azosulfone - Carbamic acid ester - Thioamide - Oxazolidine - Tertiary amine - Oxacycle - Azacycle - Thiocarboxylic acid amide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Organofluoride - Organohalogen compound - Alkyl halide - Alkyl fluoride - Carbonyl group - Organic nitrogen compound - Organic oxygen compound - Thiocarbonyl group - Amine - Organic oxide - Aromatic heteromonocyclic compound
Description
This compound belongs to the class of organic compounds known as phenylthiomorpholines. These are compounds containing a thiomorpholine ring conjugated to a phenyl group. Thiomorpholine a six-membered aliphatic ring containing one nitrogen atom and one sulfur atom at positions 1 and 4 respectively, and four carbon atoms.
External Descriptors
Not available