Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C22H19ClN6O2S |
Molecular Weight | 466.943 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
C[C@@H]1COC(NC2=CC=C3N=CN=C(NC4=CC(Cl)=C(OCC5=NC=CS5)C=C4)C3=C2)=N1
InChI
InChIKey=UWXSAYUXVSFDBQ-CYBMUJFWSA-N
InChI=1S/C22H19ClN6O2S/c1-13-10-31-22(27-13)29-14-2-4-18-16(8-14)21(26-12-25-18)28-15-3-5-19(17(23)9-15)30-11-20-24-6-7-32-20/h2-9,12-13H,10-11H2,1H3,(H,27,29)(H,25,26,28)/t13-/m1/s1
Molecular Formula | C22H19ClN6O2S |
Molecular Weight | 466.943 |
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
Fri Dec 15 16:25:34 UTC 2023
by
admin
on
Fri Dec 15 16:25:34 UTC 2023
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Record UNII |
846Y8197W1
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Record Status |
Validated (UNII)
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Record Version |
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-
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C129825
Created by
admin on Fri Dec 15 16:25:34 UTC 2023 , Edited by admin on Fri Dec 15 16:25:34 UTC 2023
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FDA ORPHAN DRUG |
524216
Created by
admin on Fri Dec 15 16:25:34 UTC 2023 , Edited by admin on Fri Dec 15 16:25:34 UTC 2023
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NCI_THESAURUS |
C2167
Created by
admin on Fri Dec 15 16:25:34 UTC 2023 , Edited by admin on Fri Dec 15 16:25:34 UTC 2023
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FDA ORPHAN DRUG |
485915
Created by
admin on Fri Dec 15 16:25:34 UTC 2023 , Edited by admin on Fri Dec 15 16:25:34 UTC 2023
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Code System | Code | Type | Description | ||
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DB05944
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DTXSID501025597
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UU-43
Created by
admin on Fri Dec 15 16:25:34 UTC 2023 , Edited by admin on Fri Dec 15 16:25:34 UTC 2023
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846Y8197W1
Created by
admin on Fri Dec 15 16:25:34 UTC 2023 , Edited by admin on Fri Dec 15 16:25:34 UTC 2023
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100000174734
Created by
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9187
Created by
admin on Fri Dec 15 16:25:34 UTC 2023 , Edited by admin on Fri Dec 15 16:25:34 UTC 2023
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C62530
Created by
admin on Fri Dec 15 16:25:34 UTC 2023 , Edited by admin on Fri Dec 15 16:25:34 UTC 2023
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845272-21-1
Created by
admin on Fri Dec 15 16:25:34 UTC 2023 , Edited by admin on Fri Dec 15 16:25:34 UTC 2023
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CHEMBL2103842
Created by
admin on Fri Dec 15 16:25:34 UTC 2023 , Edited by admin on Fri Dec 15 16:25:34 UTC 2023
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42642648
Created by
admin on Fri Dec 15 16:25:34 UTC 2023 , Edited by admin on Fri Dec 15 16:25:34 UTC 2023
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TARGET -> INHIBITOR |
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TARGET -> INHIBITOR |
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SALT/SOLVATE -> PARENT |
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