Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C19H21F3N2S.C4H4O4 |
| Molecular Weight | 482.516 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.CC(CN(C)C)CN1C2=CC=CC=C2SC3=C1C=C(C=C3)C(F)(F)F
InChI
InChIKey=MRRIMVLRWWYKTQ-BTJKTKAUSA-N
InChI=1S/C19H21F3N2S.C4H4O4/c1-13(11-23(2)3)12-24-15-6-4-5-7-17(15)25-18-9-8-14(10-16(18)24)19(20,21)22;5-3(6)1-2-4(7)8/h4-10,13H,11-12H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1-
| Molecular Formula | C4H4O4 |
| Molecular Weight | 116.0722 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Optical Activity | NONE |
| Molecular Formula | C19H21F3N2S |
| Molecular Weight | 366.444 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
Originator
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 20:23:06 GMT 2025
by
admin
on
Mon Mar 31 20:23:06 GMT 2025
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| Record UNII |
YF6LF27282
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| Record Status |
Validated (UNII)
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| Record Version |
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-
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Common Name | English | ||
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Preferred Name | English | ||
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DTXSID2046886
Created by
admin on Mon Mar 31 20:23:06 GMT 2025 , Edited by admin on Mon Mar 31 20:23:06 GMT 2025
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71609-19-3
Created by
admin on Mon Mar 31 20:23:06 GMT 2025 , Edited by admin on Mon Mar 31 20:23:06 GMT 2025
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73425460
Created by
admin on Mon Mar 31 20:23:06 GMT 2025 , Edited by admin on Mon Mar 31 20:23:06 GMT 2025
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m11115
Created by
admin on Mon Mar 31 20:23:06 GMT 2025 , Edited by admin on Mon Mar 31 20:23:06 GMT 2025
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PRIMARY | Merck Index | ||
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YF6LF27282
Created by
admin on Mon Mar 31 20:23:06 GMT 2025 , Edited by admin on Mon Mar 31 20:23:06 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
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ACTIVE MOIETY |