Details
Stereochemistry | ACHIRAL |
Molecular Formula | C29H26ClFN4O4S.2C7H8O3S |
Molecular Weight | 925.461 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=CC=C(C=C1)S(O)(=O)=O.CC2=CC=C(C=C2)S(O)(=O)=O.CS(=O)(=O)CCNCC3=CC=C(O3)C4=CC=C5N=CN=C(NC6=CC=C(OCC7=CC=CC(F)=C7)C(Cl)=C6)C5=C4
InChI
InChIKey=UWYXLGUQQFPJRI-UHFFFAOYSA-N
InChI=1S/C29H26ClFN4O4S.2C7H8O3S/c1-40(36,37)12-11-32-16-23-7-10-27(39-23)20-5-8-26-24(14-20)29(34-18-33-26)35-22-6-9-28(25(30)15-22)38-17-19-3-2-4-21(31)13-19;2*1-6-2-4-7(5-3-6)11(8,9)10/h2-10,13-15,18,32H,11-12,16-17H2,1H3,(H,33,34,35);2*2-5H,1H3,(H,8,9,10)
Molecular Formula | C7H8O3S |
Molecular Weight | 172.202 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C29H26ClFN4O4S |
Molecular Weight | 581.058 |
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 05:41:59 UTC 2023
by
admin
on
Sat Dec 16 05:41:59 UTC 2023
|
Record UNII |
4WK72K94MC
|
Record Status |
Validated (UNII)
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Record Version |
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-
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m6688
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DTXSID60959606
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admin on Sat Dec 16 05:41:59 UTC 2023 , Edited by admin on Sat Dec 16 05:41:59 UTC 2023
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388082-77-7
Created by
admin on Sat Dec 16 05:41:59 UTC 2023 , Edited by admin on Sat Dec 16 05:41:59 UTC 2023
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9941095
Created by
admin on Sat Dec 16 05:41:59 UTC 2023 , Edited by admin on Sat Dec 16 05:41:59 UTC 2023
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4WK72K94MC
Created by
admin on Sat Dec 16 05:41:59 UTC 2023 , Edited by admin on Sat Dec 16 05:41:59 UTC 2023
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PRIMARY |
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SOLVATE->ANHYDROUS |
Related Record | Type | Details | ||
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ACTIVE MOIETY |