Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C31H27F2N5O3S2.C2H4O3 |
| Molecular Weight | 695.756 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OCC(O)=O.COCCNCC1=CC=C(N=C1)C2=CC3=NC=CC(OC4=C(F)C=C(NC(=S)NC(=O)CC5=CC=C(F)C=C5)C=C4)=C3S2
InChI
InChIKey=BOWRAZCFCCNWMB-UHFFFAOYSA-N
InChI=1S/C31H27F2N5O3S2.C2H4O3/c1-40-13-12-34-17-20-4-8-24(36-18-20)28-16-25-30(43-28)27(10-11-35-25)41-26-9-7-22(15-23(26)33)37-31(42)38-29(39)14-19-2-5-21(32)6-3-19;3-1-2(4)5/h2-11,15-16,18,34H,12-14,17H2,1H3,(H2,37,38,39,42);3H,1H2,(H,4,5)
| Molecular Formula | C31H27F2N5O3S2 |
| Molecular Weight | 619.705 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C2H4O3 |
| Molecular Weight | 76.0514 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 08:23:44 UTC 2023
by
admin
on
Sat Dec 16 08:23:44 UTC 2023
|
| Record UNII |
517V126QMT
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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517V126QMT
Created by
admin on Sat Dec 16 08:23:45 UTC 2023 , Edited by admin on Sat Dec 16 08:23:45 UTC 2023
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91886000
Created by
admin on Sat Dec 16 08:23:45 UTC 2023 , Edited by admin on Sat Dec 16 08:23:45 UTC 2023
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PRIMARY |
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ACTIVE MOIETY |