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Details

Stereochemistry ACHIRAL
Molecular Formula C16H24N2O2S
Molecular Weight 308.439
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-ETHYL-2-HYDROXY-5-(ISOBUTYLAMINO)-7,7-DIMETHYL-6,7-DIHYDRO-4H-THIOPYRANO(2,3-B)PYRIDIN-4-ONE

SMILES

CCC1=C(O)SC2=NC(C)(C)CC(NCC(C)C)=C2C1=O

InChI

InChIKey=MEEKBTYLVOKWDF-UHFFFAOYSA-N
InChI=1S/C16H24N2O2S/c1-6-10-13(19)12-11(17-8-9(2)3)7-16(4,5)18-14(12)21-15(10)20/h9,17,20H,6-8H2,1-5H3

HIDE SMILES / InChI

Molecular Formula C16H24N2O2S
Molecular Weight 308.439
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:56:14 GMT 2023
Edited
by admin
on Sat Dec 16 12:56:14 GMT 2023
Record UNII
SM7M32GG2A
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-ETHYL-2-HYDROXY-5-(ISOBUTYLAMINO)-7,7-DIMETHYL-6,7-DIHYDRO-4H-THIOPYRANO(2,3-B)PYRIDIN-4-ONE
Systematic Name English
4H-THIOPYRANO(2,3-B)PYRIDIN-4-ONE, 3-ETHYL-6,7-DIHYDRO-2-HYDROXY-7,7-DIMETHYL-5-((2-METHYLPROPYL)AMINO)-
Systematic Name English
NSC-372801
Code English
3-ETHYL-6,7-DIHYDRO-2-HYDROXY-7,7-DIMETHYL-5-((2-METHYLPROPYL)AMINO)-4H-THIOPYRANO(2,3-B)PYRIDIN-4-ONE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID20232023
Created by admin on Sat Dec 16 12:56:14 GMT 2023 , Edited by admin on Sat Dec 16 12:56:14 GMT 2023
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NSC
372801
Created by admin on Sat Dec 16 12:56:14 GMT 2023 , Edited by admin on Sat Dec 16 12:56:14 GMT 2023
PRIMARY
PUBCHEM
341181
Created by admin on Sat Dec 16 12:56:14 GMT 2023 , Edited by admin on Sat Dec 16 12:56:14 GMT 2023
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FDA UNII
SM7M32GG2A
Created by admin on Sat Dec 16 12:56:14 GMT 2023 , Edited by admin on Sat Dec 16 12:56:14 GMT 2023
PRIMARY
CAS
82843-14-9
Created by admin on Sat Dec 16 12:56:14 GMT 2023 , Edited by admin on Sat Dec 16 12:56:14 GMT 2023
PRIMARY