Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C22H26F3N3OS.C4H4O4 |
| Molecular Weight | 553.594 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.OCCN1CCN(CCCN2C3=C(SC4=C2C=C(C=C4)C(F)(F)F)C=CC=C3)CC1
InChI
InChIKey=NKGQWGWZXIYMHO-BTJKTKAUSA-N
InChI=1S/C22H26F3N3OS.C4H4O4/c23-22(24,25)17-6-7-21-19(16-17)28(18-4-1-2-5-20(18)30-21)9-3-8-26-10-12-27(13-11-26)14-15-29;5-3(6)1-2-4(7)8/h1-2,4-7,16,29H,3,8-15H2;1-2H,(H,5,6)(H,7,8)/b;2-1-
Approval Year
| Name | Type | Language | ||
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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CHEMBL1200951
Created by
admin on Sat Dec 16 01:46:39 UTC 2023 , Edited by admin on Sat Dec 16 01:46:39 UTC 2023
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PRIMARY | |||
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100000089037
Created by
admin on Sat Dec 16 01:46:39 UTC 2023 , Edited by admin on Sat Dec 16 01:46:39 UTC 2023
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PRIMARY | |||
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97151695PW
Created by
admin on Sat Dec 16 01:46:39 UTC 2023 , Edited by admin on Sat Dec 16 01:46:39 UTC 2023
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PRIMARY | |||
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78126-11-1
Created by
admin on Sat Dec 16 01:46:39 UTC 2023 , Edited by admin on Sat Dec 16 01:46:39 UTC 2023
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PRIMARY | |||
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SUB22373
Created by
admin on Sat Dec 16 01:46:39 UTC 2023 , Edited by admin on Sat Dec 16 01:46:39 UTC 2023
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PRIMARY | |||
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5282479
Created by
admin on Sat Dec 16 01:46:39 UTC 2023 , Edited by admin on Sat Dec 16 01:46:39 UTC 2023
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PRIMARY |
ACTIVE MOIETY
PARENT (SALT/SOLVATE)
SUBSTANCE RECORD
