Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C16H26ClN3O3S.ClH |
| Molecular Weight | 412.375 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CCN(CC)CCNC(=O)C1=C(OCC[S+](C)[O-])C=C(N)C(Cl)=C1
InChI
InChIKey=KDAXHUZRHLYZML-UHFFFAOYSA-N
InChI=1S/C16H26ClN3O3S.ClH/c1-4-20(5-2)7-6-19-16(21)12-10-13(17)14(18)11-15(12)23-8-9-24(3)22;/h10-11H,4-9,18H2,1-3H3,(H,19,21);1H
| 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 |
| Molecular Formula | C16H26ClN3O3S |
| Molecular Weight | 375.914 |
| 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
Edited
Tue Apr 01 21:46:02 GMT 2025
by
admin
on
Tue Apr 01 21:46:02 GMT 2025
|
| Record UNII |
0FS25VJT2N
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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9822946
Created by
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0FS25VJT2N
Created by
admin on Tue Apr 01 21:46:02 GMT 2025 , Edited by admin on Tue Apr 01 21:46:02 GMT 2025
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125557-35-9
Created by
admin on Tue Apr 01 21:46:02 GMT 2025 , Edited by admin on Tue Apr 01 21:46:02 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |