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Details

Stereochemistry ACHIRAL
Molecular Formula C5H5NOS.C4H11N
Molecular Weight 200.301
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PYRITHIONE TERT-BUTYLAMINE

SMILES

CC(C)(C)N.[O-][N+]1=CC=CC=C1S

InChI

InChIKey=OMAFSMPKAYGVNP-UHFFFAOYSA-N
InChI=1S/C5H5NOS.C4H11N/c7-6-4-2-1-3-5(6)8;1-4(2,3)5/h1-4,8H;5H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C4H11N
Molecular Weight 73.1368
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C5H5NOS
Molecular Weight 127.164
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 22:59:31 GMT 2025
Edited
by admin
on Mon Mar 31 22:59:31 GMT 2025
Record UNII
58Y0H6VVE2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
OMADINE TBAO
Preferred Name English
PYRITHIONE TERT-BUTYLAMINE
Common Name English
2-PYRIDINETHIOL, 1-OXIDE, COMPD. WITH TERT-BUTYLAMINE (1:1)
Systematic Name English
2-PYRIDINETHIOL-1-OXIDE, 1,1-DIMETHYLETHANAMINE SALT
Systematic Name English
TERT-BUTYLAMINE 2-PYRIDINETHIOL-1-OXIDE
Systematic Name English
Classification Tree Code System Code
EPA PESTICIDE CODE 88005
Created by admin on Mon Mar 31 22:59:31 GMT 2025 , Edited by admin on Mon Mar 31 22:59:31 GMT 2025
Code System Code Type Description
FDA UNII
58Y0H6VVE2
Created by admin on Mon Mar 31 22:59:31 GMT 2025 , Edited by admin on Mon Mar 31 22:59:31 GMT 2025
PRIMARY
CAS
33079-08-2
Created by admin on Mon Mar 31 22:59:31 GMT 2025 , Edited by admin on Mon Mar 31 22:59:31 GMT 2025
PRIMARY
EPA CompTox
DTXSID5048055
Created by admin on Mon Mar 31 22:59:31 GMT 2025 , Edited by admin on Mon Mar 31 22:59:31 GMT 2025
PRIMARY
PUBCHEM
61919
Created by admin on Mon Mar 31 22:59:31 GMT 2025 , Edited by admin on Mon Mar 31 22:59:31 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE