Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C23H20F2N5O5PS.C6H14N2O2 |
| Molecular Weight | 693.659 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 3 / 3 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
NCCCC[C@H](N)C(O)=O.C[C@@H](C1=NC(=CS1)C2=CC=C(C=C2)C#N)[C@@](CN3C=NC=N3)(OCOP(O)(O)=O)C4=CC=C(F)C=C4F
InChI
InChIKey=GTJFQIOLLGYOSL-SWQYEYERSA-N
InChI=1S/C23H20F2N5O5PS.C6H14N2O2/c1-15(22-29-21(10-37-22)17-4-2-16(9-26)3-5-17)23(11-30-13-27-12-28-30,34-14-35-36(31,32)33)19-7-6-18(24)8-20(19)25;7-4-2-1-3-5(8)6(9)10/h2-8,10,12-13,15H,11,14H2,1H3,(H2,31,32,33);5H,1-4,7-8H2,(H,9,10)/t15-,23+;5-/m00/s1
| Molecular Formula | C23H20F2N5O5PS |
| Molecular Weight | 547.471 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | C6H14N2O2 |
| Molecular Weight | 146.1876 |
| 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
Sat Dec 16 08:01:42 UTC 2023
by
admin
on
Sat Dec 16 08:01:42 UTC 2023
|
| Record UNII |
0R566UQ5QN
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
|
Common Name | English | ||
|
Systematic Name | English | ||
|
Common Name | English | ||
|
Common Name | English |
| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
|
119025899
Created by
admin on Sat Dec 16 08:01:42 UTC 2023 , Edited by admin on Sat Dec 16 08:01:42 UTC 2023
|
PRIMARY | |||
|
0R566UQ5QN
Created by
admin on Sat Dec 16 08:01:42 UTC 2023 , Edited by admin on Sat Dec 16 08:01:42 UTC 2023
|
PRIMARY | |||
|
914361-44-7
Created by
admin on Sat Dec 16 08:01:42 UTC 2023 , Edited by admin on Sat Dec 16 08:01:42 UTC 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
SOLVATE->ANHYDROUS | |||
|
|
PARENT -> SALT/SOLVATE |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
|
ACTIVE MOIETY |