Details
| Stereochemistry | RACEMIC |
| Molecular Formula | 2C16H14F2N3O4S.Mg |
| Molecular Weight | 789.029 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
[Mg++].COC1=CC=NC(C[S+]([O-])C2=NC3=C([N-]2)C=C(OC(F)F)C=C3)=C1OC.COC4=CC=NC(C[S+]([O-])C5=NC6=C([N-]5)C=C(OC(F)F)C=C6)=C4OC
InChI
InChIKey=RDRUTBCDIVCMMX-UHFFFAOYSA-N
InChI=1S/2C16H14F2N3O4S.Mg/c2*1-23-13-5-6-19-12(14(13)24-2)8-26(22)16-20-10-4-3-9(25-15(17)18)7-11(10)21-16;/h2*3-7,15H,8H2,1-2H3;/q2*-1;+2
| Molecular Formula | Mg |
| Molecular Weight | 24.305 |
| Charge | 2 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C16H15F2N3O4S |
| Molecular Weight | 383.37 |
| 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
Fri Dec 15 17:58:22 UTC 2023
by
admin
on
Fri Dec 15 17:58:22 UTC 2023
|
| Record UNII |
1AL13B11R4
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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1AL13B11R4
Created by
admin on Fri Dec 15 17:58:22 UTC 2023 , Edited by admin on Fri Dec 15 17:58:22 UTC 2023
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SUB22265
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DBSALT000853
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199387-73-0
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71587624
Created by
admin on Fri Dec 15 17:58:22 UTC 2023 , Edited by admin on Fri Dec 15 17:58:22 UTC 2023
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100000085425
Created by
admin on Fri Dec 15 17:58:22 UTC 2023 , Edited by admin on Fri Dec 15 17:58:22 UTC 2023
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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SOLVATE->ANHYDROUS |
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SOLVATE->ANHYDROUS |
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PARENT -> SALT/SOLVATE |
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
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