Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C12H16N2O2S |
| Molecular Weight | 252.333 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=CC=CC(C)=C1NC2=NCCCS2(=O)=O
InChI
InChIKey=KDYHYUCBMNNNCG-UHFFFAOYSA-N
InChI=1S/C12H16N2O2S/c1-9-5-3-6-10(2)11(9)14-12-13-7-4-8-17(12,15)16/h3,5-6H,4,7-8H2,1-2H3,(H,13,14)
| Molecular Formula | C12H16N2O2S |
| Molecular Weight | 252.333 |
| 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
Wed Apr 02 16:15:45 GMT 2025
by
admin
on
Wed Apr 02 16:15:45 GMT 2025
|
| Record UNII |
P96GBF7HMK
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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Preferred Name | English | ||
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Common Name | English |
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P96GBF7HMK
Created by
admin on Wed Apr 02 16:15:45 GMT 2025 , Edited by admin on Wed Apr 02 16:15:45 GMT 2025
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1473376-47-4
Created by
admin on Wed Apr 02 16:15:45 GMT 2025 , Edited by admin on Wed Apr 02 16:15:45 GMT 2025
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166451450
Created by
admin on Wed Apr 02 16:15:45 GMT 2025 , Edited by admin on Wed Apr 02 16:15:45 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE |
MINOR
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