Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C18H17F4N3O3.CH4O3S |
| Molecular Weight | 495.445 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CS(O)(=O)=O.NCC1=CC(=NC(OC2=CC=CC(=C2)C(=O)N3C[C@@H](O)[C@H](F)C3)=C1)C(F)(F)F
InChI
InChIKey=FNUHFAFCXUWHCH-DTPOWOMPSA-N
InChI=1S/C18H17F4N3O3.CH4O3S/c19-13-8-25(9-14(13)26)17(27)11-2-1-3-12(6-11)28-16-5-10(7-23)4-15(24-16)18(20,21)22;1-5(2,3)4/h1-6,13-14,26H,7-9,23H2;1H3,(H,2,3,4)/t13-,14-;/m1./s1
| Molecular Formula | C18H17F4N3O3 |
| Molecular Weight | 399.3395 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| 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 |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 08:44:22 GMT 2025
by
admin
on
Wed Apr 02 08:44:22 GMT 2025
|
| Record UNII |
G5628N5SH2
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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Preferred Name | English | ||
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300000028792
Created by
admin on Wed Apr 02 08:44:22 GMT 2025 , Edited by admin on Wed Apr 02 08:44:22 GMT 2025
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G5628N5SH2
Created by
admin on Wed Apr 02 08:44:22 GMT 2025 , Edited by admin on Wed Apr 02 08:44:22 GMT 2025
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154731649
Created by
admin on Wed Apr 02 08:44:22 GMT 2025 , Edited by admin on Wed Apr 02 08:44:22 GMT 2025
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2205037-03-0
Created by
admin on Wed Apr 02 08:44:22 GMT 2025 , Edited by admin on Wed Apr 02 08:44:22 GMT 2025
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PRIMARY |
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|---|---|---|---|---|
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
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