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 | C19H21F3N2S |
Molecular Weight | 366.444 |
Charge | 0 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Optical Activity | ( + / - ) |
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 |
Originator
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 22:03:19 GMT 2023
by
admin
on
Fri Dec 15 22:03:19 GMT 2023
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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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DTXSID2046886
Created by
admin on Fri Dec 15 22:03:19 GMT 2023 , Edited by admin on Fri Dec 15 22:03:19 GMT 2023
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71609-19-3
Created by
admin on Fri Dec 15 22:03:19 GMT 2023 , Edited by admin on Fri Dec 15 22:03:19 GMT 2023
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73425460
Created by
admin on Fri Dec 15 22:03:19 GMT 2023 , Edited by admin on Fri Dec 15 22:03:19 GMT 2023
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m11115
Created by
admin on Fri Dec 15 22:03:19 GMT 2023 , Edited by admin on Fri Dec 15 22:03:19 GMT 2023
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PRIMARY | Merck Index | ||
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YF6LF27282
Created by
admin on Fri Dec 15 22:03:19 GMT 2023 , Edited by admin on Fri Dec 15 22:03:19 GMT 2023
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PRIMARY |
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |