Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C16H23N4O2S3.Cl |
| Molecular Weight | 435.027 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Cl-].C[S+](C)CCCNC(=O)C1=CSC(=N1)C2=CSC(CCNC(C)=O)=N2
InChI
InChIKey=TYOQVVVKESCAOH-UHFFFAOYSA-N
InChI=1S/C16H22N4O2S3.ClH/c1-11(21)17-7-5-14-19-13(10-23-14)16-20-12(9-24-16)15(22)18-6-4-8-25(2)3;/h9-10H,4-8H2,1-3H3,(H-,17,18,21,22);1H
| Molecular Formula | Cl |
| Molecular Weight | 35.453 |
| Charge | -1 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C16H23N4O2S3 |
| Molecular Weight | 399.574 |
| 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
Edited
Tue Apr 01 19:36:49 GMT 2025
by
admin
on
Tue Apr 01 19:36:49 GMT 2025
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| Record UNII |
QGM6UMS4GQ
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| Record Status |
Validated (UNII)
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| Record Version |
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153682
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76275-84-8
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DTXSID00997628
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359284
Created by
admin on Tue Apr 01 19:36:49 GMT 2025 , Edited by admin on Tue Apr 01 19:36:49 GMT 2025
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| Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
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![Structure of [3-[[[2?-[2-(Acetylamino)ethyl][2,4?-bithiazol]-4-yl]carbonyl]amino]propyl]dimethylsulfonium](/img/b97cfa51-100f-456a-9a60-2f2794572271.svg "Structure of [3-[[[2?-[2-(Acetylamino)ethyl][2,4?-bithiazol]-4-yl]carbonyl]amino]propyl]dimethylsulfonium")