Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C21H19ClF3N5O2.2C4H4O4 |
| Molecular Weight | 698.0 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 3 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.OC(=O)\C=C/C(O)=O.CN(C)C\C=C\C(=O)NC1=CC2=C(C=C1OC(F)F)N=CN=C2NC3=CC(Cl)=C(F)C=C3
InChI
InChIKey=AUGQPHRSSXWEBH-LTOSPQESSA-N
InChI=1S/C21H19ClF3N5O2.2C4H4O4/c1-30(2)7-3-4-19(31)29-17-9-13-16(10-18(17)32-21(24)25)26-11-27-20(13)28-12-5-6-15(23)14(22)8-12;2*5-3(6)1-2-4(7)8/h3-6,8-11,21H,7H2,1-2H3,(H,29,31)(H,26,27,28);2*1-2H,(H,5,6)(H,7,8)/b4-3+;2*2-1-
| Molecular Formula | C21H19ClF3N5O2 |
| Molecular Weight | 465.856 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Optical Activity | NONE |
| Molecular Formula | C4H4O4 |
| Molecular Weight | 116.0722 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 14:54:07 GMT 2023
by
admin
on
Sat Dec 16 14:54:07 GMT 2023
|
| Record UNII |
B01OYP3J6F
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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B01OYP3J6F
Created by
admin on Sat Dec 16 14:54:07 GMT 2023 , Edited by admin on Sat Dec 16 14:54:07 GMT 2023
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PRIMARY | |||
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168006922
Created by
admin on Sat Dec 16 14:54:07 GMT 2023 , Edited by admin on Sat Dec 16 14:54:07 GMT 2023
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1989592-50-8
Created by
admin on Sat Dec 16 14:54:07 GMT 2023 , Edited by admin on Sat Dec 16 14:54:07 GMT 2023
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PRIMARY |