Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C21H23N5O2S.2BrH |
| Molecular Weight | 571.329 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Br.Br.CC[C@@H]1CNC[C@@H]1C2=CN=C3C=NC4=C(C=CN4S(=O)(=O)C5=CC=C(C)C=C5)N23
InChI
InChIKey=WTLFERTYKDXISE-CKDKJTBNSA-N
InChI=1S/C21H23N5O2S.2BrH/c1-3-15-10-22-11-17(15)19-12-23-20-13-24-21-18(26(19)20)8-9-25(21)29(27,28)16-6-4-14(2)5-7-16;;/h4-9,12-13,15,17,22H,3,10-11H2,1-2H3;2*1H/t15-,17+;;/m1../s1
| Molecular Formula | C21H23N5O2S |
| Molecular Weight | 409.505 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | BrH |
| Molecular Weight | 80.912 |
| 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 19:55:08 GMT 2025
by
admin
on
Wed Apr 02 19:55:08 GMT 2025
|
| Record UNII |
YU67N2V4QJ
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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Systematic Name | English |
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1447673-33-7
Created by
admin on Wed Apr 02 19:55:08 GMT 2025 , Edited by admin on Wed Apr 02 19:55:08 GMT 2025
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YU67N2V4QJ
Created by
admin on Wed Apr 02 19:55:08 GMT 2025 , Edited by admin on Wed Apr 02 19:55:08 GMT 2025
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86678507
Created by
admin on Wed Apr 02 19:55:08 GMT 2025 , Edited by admin on Wed Apr 02 19:55:08 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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![Structure of 8-((3R,4S)-4-Ethylpyrrolidin-3-yl)-3-tosyl-3H-imidazo[1,2-a]pyrrolo[2,3-e]pyrazine](/img/97ba90a2-69ca-4741-8626-c1fcef95413d.svg "Structure of 8-((3R,4S)-4-Ethylpyrrolidin-3-yl)-3-tosyl-3H-imidazo[1,2-a]pyrrolo[2,3-e]pyrazine")