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Details

Stereochemistry ACHIRAL
Molecular Formula C12H17N4OS3.Cl
Molecular Weight 364.938
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of [3-[[(2?-Amino[2,4?-bithiazol]-4-yl)carbonyl]amino]propyl]dimethylsulfonium chloride

SMILES

[Cl-].C[S+](C)CCCNC(=O)C1=CSC(=N1)C2=CSC(N)=N2

InChI

InChIKey=WLULKYBTJBXUMY-UHFFFAOYSA-N
InChI=1S/C12H16N4OS3.ClH/c1-20(2)5-3-4-14-10(17)8-6-18-11(15-8)9-7-19-12(13)16-9;/h6-7H,3-5H2,1-2H3,(H2-,13,14,16,17);1H

HIDE SMILES / InChI

Approval Year

Name Type Language
NSC-359280
Preferred Name English
[3-[[(2?-Amino[2,4?-bithiazol]-4-yl)carbonyl]amino]propyl]dimethylsulfonium chloride
Systematic Name English
Sulfonium, [3-[[(2?-amino[2,4?-bithiazol]-4-yl)carbonyl]amino]propyl]dimethyl-, chloride
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID901001169
Created by admin on Tue Apr 01 19:37:57 GMT 2025 , Edited by admin on Tue Apr 01 19:37:57 GMT 2025
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CAS
80337-66-2
Created by admin on Tue Apr 01 19:37:57 GMT 2025 , Edited by admin on Tue Apr 01 19:37:57 GMT 2025
PRIMARY
NSC
359280
Created by admin on Tue Apr 01 19:37:57 GMT 2025 , Edited by admin on Tue Apr 01 19:37:57 GMT 2025
PRIMARY
FDA UNII
HMW39X9AG7
Created by admin on Tue Apr 01 19:37:57 GMT 2025 , Edited by admin on Tue Apr 01 19:37:57 GMT 2025
PRIMARY
PUBCHEM
149816
Created by admin on Tue Apr 01 19:37:57 GMT 2025 , Edited by admin on Tue Apr 01 19:37:57 GMT 2025
PRIMARY