Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C20H19ClF3N3O4 |
| Molecular Weight | 457.831 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=C(N=CC(=N1)N(CC(C)(C)F)C2=C(F)C=C(F)C(Cl)=C2)C(=O)[C@@H]3C[C@H]3C(O)=O
InChI
InChIKey=RVMWIVNHZMXEHS-NXEZZACHSA-N
InChI=1S/C20H19ClF3N3O4/c1-20(2,24)8-27(14-5-11(21)12(22)6-13(14)23)15-7-25-16(18(26-15)31-3)17(28)9-4-10(9)19(29)30/h5-7,9-10H,4,8H2,1-3H3,(H,29,30)/t9-,10-/m1/s1
| Molecular Formula | C20H19ClF3N3O4 |
| Molecular Weight | 457.831 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 20:24:08 GMT 2025
by
admin
on
Wed Apr 02 20:24:08 GMT 2025
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| Record UNII |
6PFX2QSH7F
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| Record Status |
Validated (UNII)
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| Record Version |
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-
Download
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Preferred Name | English | ||
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Systematic Name | English | ||
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Systematic Name | English | ||
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Systematic Name | English |
| Code System | Code | Type | Description | ||
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2042347-75-9
Created by
admin on Wed Apr 02 20:24:08 GMT 2025 , Edited by admin on Wed Apr 02 20:24:08 GMT 2025
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PRIMARY | |||
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6PFX2QSH7F
Created by
admin on Wed Apr 02 20:24:08 GMT 2025 , Edited by admin on Wed Apr 02 20:24:08 GMT 2025
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ENANTIOMER -> RACEMATE |
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ENANTIOMER -> RACEMATE |
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![Structure of 2-[[5-[(5-Chloro-2,4-difluorophenyl)(2-fluoro-2-methylpropyl)amino]-3-methoxy-2-pyrazinyl]carbonyl]cyclopropanecarboxylic acid, (1R,2R)-](/img/789e58e3-7a8c-4828-98d2-ac22b325bc7f.svg "Structure of 2-[[5-[(5-Chloro-2,4-difluorophenyl)(2-fluoro-2-methylpropyl)amino]-3-methoxy-2-pyrazinyl]carbonyl]cyclopropanecarboxylic acid, (1R,2R)-")
