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Details

Stereochemistry ACHIRAL
Molecular Formula C12H24N2O3S2
Molecular Weight 308.461
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-[(1-amino-2-sulfosulfanylethylidene)amino]butylcyclohexane

SMILES

OS(=O)(=O)SCC(=N)NCCCCC1CCCCC1

InChI

InChIKey=AYXXZCZXYOGKNY-UHFFFAOYSA-N
InChI=1S/C12H24N2O3S2/c13-12(10-18-19(15,16)17)14-9-5-4-8-11-6-2-1-3-7-11/h11H,1-10H2,(H2,13,14)(H,15,16,17)

HIDE SMILES / InChI

Molecular Formula C12H24N2O3S2
Molecular Weight 308.461
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 Tue Apr 01 20:17:46 GMT 2025
Edited
by admin
on Tue Apr 01 20:17:46 GMT 2025
Record UNII
A68TEH9KGL
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-[(1-amino-2-sulfosulfanylethylidene)amino]butylcyclohexane
Systematic Name English
NSC-194282
Preferred Name English
WR-4555
Code English
Thiosulfuric acid (H2S2O3), S-[2-[(4-cyclohexylbutyl)amino]-2-iminoethyl] ester
Common Name English
METHANETHIOL, (N-CYCLOHEXYLBUTYL)AMIDINO-, HYDROGEN THIOSULFATE
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID90193278
Created by admin on Tue Apr 01 20:17:46 GMT 2025 , Edited by admin on Tue Apr 01 20:17:46 GMT 2025
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CAS
40283-59-8
Created by admin on Tue Apr 01 20:17:46 GMT 2025 , Edited by admin on Tue Apr 01 20:17:46 GMT 2025
PRIMARY
NSC
194282
Created by admin on Tue Apr 01 20:17:46 GMT 2025 , Edited by admin on Tue Apr 01 20:17:46 GMT 2025
PRIMARY
FDA UNII
A68TEH9KGL
Created by admin on Tue Apr 01 20:17:46 GMT 2025 , Edited by admin on Tue Apr 01 20:17:46 GMT 2025
PRIMARY
PUBCHEM
99186
Created by admin on Tue Apr 01 20:17:46 GMT 2025 , Edited by admin on Tue Apr 01 20:17:46 GMT 2025
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