U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C4H7NS.ClH
Molecular Weight 137.631
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-Iminothiolane hydrochloride

SMILES

Cl.N=C1CCCS1

InChI

InChIKey=ATGUDZODTABURZ-UHFFFAOYSA-N
InChI=1S/C4H7NS.ClH/c5-4-2-1-3-6-4;/h5H,1-3H2;1H

HIDE SMILES / InChI

Molecular Formula C4H7NS
Molecular Weight 101.17
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula ClH
Molecular Weight 36.461
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 19:13:48 GMT 2023
Edited
by admin
on Sat Dec 16 19:13:48 GMT 2023
Record UNII
W688HZV733
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-Iminothiolane hydrochloride
Systematic Name English
Traut's reagent
Common Name English
THIOLAN-2-IMINE HYDROCHLORIDE
Systematic Name English
2(3H)-THIOPHENIMINE, DIHYDRO-, HYDROCHLORIDE
Systematic Name English
NSC-340007
Code English
Code System Code Type Description
PUBCHEM
13166855
Created by admin on Sat Dec 16 19:13:48 GMT 2023 , Edited by admin on Sat Dec 16 19:13:48 GMT 2023
PRIMARY
CAS
4781-83-3
Created by admin on Sat Dec 16 19:13:48 GMT 2023 , Edited by admin on Sat Dec 16 19:13:48 GMT 2023
PRIMARY
FDA UNII
W688HZV733
Created by admin on Sat Dec 16 19:13:48 GMT 2023 , Edited by admin on Sat Dec 16 19:13:48 GMT 2023
PRIMARY
EPA CompTox
DTXSID60524217
Created by admin on Sat Dec 16 19:13:48 GMT 2023 , Edited by admin on Sat Dec 16 19:13:48 GMT 2023
PRIMARY
NSC
340007
Created by admin on Sat Dec 16 19:13:48 GMT 2023 , Edited by admin on Sat Dec 16 19:13:48 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE