Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C20H15F3N4O2 |
| Molecular Weight | 400.3539 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
C[C@H](N(C)C(=O)NC1=CC(C#N)=C(F)C=C1)C2=CNC(=O)C3=C2C=C(F)C(F)=C3
InChI
InChIKey=WKCMLORRPISTPL-JTQLQIEISA-N
InChI=1S/C20H15F3N4O2/c1-10(15-9-25-19(28)14-7-18(23)17(22)6-13(14)15)27(2)20(29)26-12-3-4-16(21)11(5-12)8-24/h3-7,9-10H,1-2H3,(H,25,28)(H,26,29)/t10-/m0/s1
| Molecular Formula | C20H15F3N4O2 |
| Molecular Weight | 400.3539 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Wed Apr 02 16:13:59 GMT 2025
by
admin
on
Wed Apr 02 16:13:59 GMT 2025
|
| Record UNII |
9L2U2LTX36
|
| 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 |
| Code System | Code | Type | Description | ||
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153609859
Created by
admin on Wed Apr 02 16:13:59 GMT 2025 , Edited by admin on Wed Apr 02 16:13:59 GMT 2025
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PRIMARY | |||
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2445597-28-2
Created by
admin on Wed Apr 02 16:13:59 GMT 2025 , Edited by admin on Wed Apr 02 16:13:59 GMT 2025
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PRIMARY | |||
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9L2U2LTX36
Created by
admin on Wed Apr 02 16:13:59 GMT 2025 , Edited by admin on Wed Apr 02 16:13:59 GMT 2025
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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RACEMATE -> ENANTIOMER |
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ENANTIOMER -> ENANTIOMER |
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![Structure of N?-(3-Cyano-4-fluorophenyl)-N-[1-(6,7-difluoro-1,2-dihydro-1-oxo-4-isoquinolinyl)ethyl]-N-methylurea](/img/a18d1c42-d331-4f99-ab32-ff59310ed74c.svg "Structure of N?-(3-Cyano-4-fluorophenyl)-N-[1-(6,7-difluoro-1,2-dihydro-1-oxo-4-isoquinolinyl)ethyl]-N-methylurea")
