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

Details

Stereochemistry ACHIRAL
Molecular Formula C2H3N4S.Na
Molecular Weight 138.127
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of sodium 1-methyltetrazole-5-thiolate

SMILES

[Na+].CN1[N-]N=NC1=S

InChI

InChIKey=OUHLMDFGPKSIAL-UHFFFAOYSA-M
InChI=1S/C2H4N4S.Na/c1-6-2(7)3-4-5-6;/h1H3,(H,3,5,7);/q;+1/p-1

HIDE SMILES / InChI

Molecular Formula C2H4N4S
Molecular Weight 116.145
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Na
Molecular Weight 22.9898
Charge 1
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 11:58:13 GMT 2023
Edited
by admin
on Sat Dec 16 11:58:13 GMT 2023
Record UNII
3XAQ72JS2M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
sodium 1-methyltetrazole-5-thiolate
Systematic Name English
NMTT Sodium Salt
Common Name English
5H-Tetrazole-5-thione, 1,2-dihydro-1-methyl-, sodium salt (1:1)
Systematic Name English
Code System Code Type Description
CAS
51138-06-8
Created by admin on Sat Dec 16 11:58:13 GMT 2023 , Edited by admin on Sat Dec 16 11:58:13 GMT 2023
PRIMARY
FDA UNII
3XAQ72JS2M
Created by admin on Sat Dec 16 11:58:13 GMT 2023 , Edited by admin on Sat Dec 16 11:58:13 GMT 2023
PRIMARY
PUBCHEM
2723771
Created by admin on Sat Dec 16 11:58:13 GMT 2023 , Edited by admin on Sat Dec 16 11:58:13 GMT 2023
PRIMARY
ECHA (EC/EINECS)
257-006-3
Created by admin on Sat Dec 16 11:58:13 GMT 2023 , Edited by admin on Sat Dec 16 11:58:13 GMT 2023
PRIMARY
EPA CompTox
DTXSID8068622
Created by admin on Sat Dec 16 11:58:13 GMT 2023 , Edited by admin on Sat Dec 16 11:58:13 GMT 2023
PRIMARY