Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C22H17FN4O2.C6H6O3S |
| Molecular Weight | 546.569 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OS(=O)(=O)C1=CC=CC=C1.FC2=C(NC(=O)N[C@H]3N=C(C4=CC=CC=C4)C5=C(NC3=O)C=CC=C5)C=CC=C2
InChI
InChIKey=GPMMHUHNHFLUPP-VEIFNGETSA-N
InChI=1S/C22H17FN4O2.C6H6O3S/c23-16-11-5-7-13-18(16)25-22(29)27-20-21(28)24-17-12-6-4-10-15(17)19(26-20)14-8-2-1-3-9-14;7-10(8,9)6-4-2-1-3-5-6/h1-13,20H,(H,24,28)(H2,25,27,29);1-5H,(H,7,8,9)/t20-;/m1./s1
| Molecular Formula | C22H17FN4O2 |
| Molecular Weight | 388.3944 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | C6H6O3S |
| Molecular Weight | 158.175 |
| 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 20:08:43 GMT 2025
by
admin
on
Wed Apr 02 20:08:43 GMT 2025
|
| Record UNII |
77E8A563J7
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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Common Name | English | ||
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Preferred Name | English |
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23652971
Created by
admin on Wed Apr 02 20:08:43 GMT 2025 , Edited by admin on Wed Apr 02 20:08:43 GMT 2025
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77E8A563J7
Created by
admin on Wed Apr 02 20:08:43 GMT 2025 , Edited by admin on Wed Apr 02 20:08:43 GMT 2025
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959391-59-4
Created by
admin on Wed Apr 02 20:08:43 GMT 2025 , Edited by admin on Wed Apr 02 20:08:43 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> SALT/SOLVATE |
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SOLVATE->ANHYDROUS |
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