Details
Stereochemistry | ACHIRAL |
Molecular Formula | C25H34N4O5S |
Molecular Weight | 502.626 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
COC1=CC(C)=C(C(C)=C1)S(=O)(=O)N(C)CCOCC(=O)N(C)CC2=CC=C(C=C2)C3=NCCN3
InChI
InChIKey=AMTQCENHQIDBHQ-UHFFFAOYSA-N
InChI=1S/C25H34N4O5S/c1-18-14-22(33-5)15-19(2)24(18)35(31,32)29(4)12-13-34-17-23(30)28(3)16-20-6-8-21(9-7-20)25-26-10-11-27-25/h6-9,14-15H,10-13,16-17H2,1-5H3,(H,26,27)
Molecular Formula | C25H34N4O5S |
Molecular Weight | 502.626 |
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
Fri Dec 15 21:16:39 UTC 2023
by
admin
on
Fri Dec 15 21:16:39 UTC 2023
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Record UNII |
02HU8HWP7U
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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 |
C257
Created by
admin on Fri Dec 15 21:16:39 UTC 2023 , Edited by admin on Fri Dec 15 21:16:39 UTC 2023
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Code System | Code | Type | Description | ||
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C152283
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300000034400
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admin on Fri Dec 15 21:16:39 UTC 2023 , Edited by admin on Fri Dec 15 21:16:39 UTC 2023
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11953367
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DTXSID20212769
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9479
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admin on Fri Dec 15 21:16:39 UTC 2023 , Edited by admin on Fri Dec 15 21:16:39 UTC 2023
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CHEMBL1254771
Created by
admin on Fri Dec 15 21:16:39 UTC 2023 , Edited by admin on Fri Dec 15 21:16:39 UTC 2023
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Safotibant
Created by
admin on Fri Dec 15 21:16:39 UTC 2023 , Edited by admin on Fri Dec 15 21:16:39 UTC 2023
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02HU8HWP7U
Created by
admin on Fri Dec 15 21:16:39 UTC 2023 , Edited by admin on Fri Dec 15 21:16:39 UTC 2023
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633698-99-4
Created by
admin on Fri Dec 15 21:16:39 UTC 2023 , Edited by admin on Fri Dec 15 21:16:39 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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SALT/SOLVATE -> PARENT |
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TARGET -> INHIBITOR |
Ki
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Related Record | Type | Details | ||
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ACTIVE MOIETY |
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