Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C28H23Cl2F2N9O2.C2HF3O2 |
| Molecular Weight | 740.467 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)C(F)(F)F.C[C@@H]1CCC[C@H](N2C=NC(=CC2=O)C3=CC(Cl)=CC=C3N4C=C(Cl)N=N4)C5=CC(=CC=N5)C6=C(NC1=O)C=NN6C(F)F
InChI
InChIKey=BNDDKCJHMXEGIX-WUTOIGTNSA-N
InChI=1S/C28H23Cl2F2N9O2.C2HF3O2/c1-15-3-2-4-23(20-9-16(7-8-33-20)26-21(36-27(15)43)12-35-41(26)28(31)32)39-14-34-19(11-25(39)42)18-10-17(29)5-6-22(18)40-13-24(30)37-38-40;3-2(4,5)1(6)7/h5-15,23,28H,2-4H2,1H3,(H,36,43);(H,6,7)/t15-,23+;/m1./s1
| Molecular Formula | C2HF3O2 |
| Molecular Weight | 114.0233 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C28H23Cl2F2N9O2 |
| Molecular Weight | 626.444 |
| 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
Sat Dec 16 15:26:29 GMT 2023
by
admin
on
Sat Dec 16 15:26:29 GMT 2023
|
| Record UNII |
4A3MKD2ZOP
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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Systematic Name | English |
| Code System | Code | Type | Description | ||
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1900687-79-7
Created by
admin on Sat Dec 16 15:26:29 GMT 2023 , Edited by admin on Sat Dec 16 15:26:29 GMT 2023
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NON-SPECIFIC STOICHIOMETRY | |||
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1802426-00-1
Created by
admin on Sat Dec 16 15:26:29 GMT 2023 , Edited by admin on Sat Dec 16 15:26:29 GMT 2023
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PRIMARY | |||
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118277543
Created by
admin on Sat Dec 16 15:26:29 GMT 2023 , Edited by admin on Sat Dec 16 15:26:29 GMT 2023
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PRIMARY | |||
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4A3MKD2ZOP
Created by
admin on Sat Dec 16 15:26:29 GMT 2023 , Edited by admin on Sat Dec 16 15:26:29 GMT 2023
|
PRIMARY |
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|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |