Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C21H22BrFN4O3S.CH4O3S |
| Molecular Weight | 605.497 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CS(O)(=O)=O.CCOC(=O)C1=C(CN2CCOCC2)NC(=NC1C3=CC=C(F)C=C3Br)C4=NC=CS4
InChI
InChIKey=FDMKMKYZDJHHFM-UHFFFAOYSA-N
InChI=1S/C21H22BrFN4O3S.CH4O3S/c1-2-30-21(28)17-16(12-27-6-8-29-9-7-27)25-19(20-24-5-10-31-20)26-18(17)14-4-3-13(23)11-15(14)22;1-5(2,3)4/h3-5,10-11,18H,2,6-9,12H2,1H3,(H,25,26);1H3,(H,2,3,4)
| Molecular Formula | CH4O3S |
| Molecular Weight | 96.106 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C21H22BrFN4O3S |
| Molecular Weight | 509.392 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 19:07:12 UTC 2023
by
admin
on
Sat Dec 16 19:07:12 UTC 2023
|
| Record UNII |
AY5C7Q89Z2
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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Common Name | English | ||
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| Code System | Code | Type | Description | ||
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1646361-04-7
Created by
admin on Sat Dec 16 19:07:12 UTC 2023 , Edited by admin on Sat Dec 16 19:07:12 UTC 2023
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PRIMARY | |||
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AY5C7Q89Z2
Created by
admin on Sat Dec 16 19:07:12 UTC 2023 , Edited by admin on Sat Dec 16 19:07:12 UTC 2023
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PRIMARY | |||
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73437659
Created by
admin on Sat Dec 16 19:07:12 UTC 2023 , Edited by admin on Sat Dec 16 19:07:12 UTC 2023
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PRIMARY | PUBCHEM |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> SALT/SOLVATE |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |