Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C19H18FN3O.C10H16O4S |
Molecular Weight | 555.661 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1(C)[C@@H]2CC[C@@]1(CS(O)(=O)=O)C(=O)C2.CNCC3=CC=C(C=C3)C4=C5CCNC(=O)C6=C5C(N4)=CC(F)=C6
InChI
InChIKey=INBJJAFXHQQSRW-STOWLHSFSA-N
InChI=1S/C19H18FN3O.C10H16O4S/c1-21-10-11-2-4-12(5-3-11)18-14-6-7-22-19(24)15-8-13(20)9-16(23-18)17(14)15;1-9(2)7-3-4-10(9,8(11)5-7)6-15(12,13)14/h2-5,8-9,21,23H,6-7,10H2,1H3,(H,22,24);7H,3-6H2,1-2H3,(H,12,13,14)/t;7-,10-/m.1/s1
Molecular Formula | C10H16O4S |
Molecular Weight | 232.297 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C19H18FN3O |
Molecular Weight | 323.3641 |
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 12:07:16 UTC 2023
by
admin
on
Sat Dec 16 12:07:16 UTC 2023
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Record UNII |
41AX9SJ8KO
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Record Status |
Validated (UNII)
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Record Version |
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-
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Code | English | ||
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Systematic Name | English |
Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C62554
Created by
admin on Sat Dec 16 12:07:16 UTC 2023 , Edited by admin on Sat Dec 16 12:07:16 UTC 2023
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Code System | Code | Type | Description | ||
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100000169849
Created by
admin on Sat Dec 16 12:07:16 UTC 2023 , Edited by admin on Sat Dec 16 12:07:16 UTC 2023
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PRIMARY | |||
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1862578
Created by
admin on Sat Dec 16 12:07:16 UTC 2023 , Edited by admin on Sat Dec 16 12:07:16 UTC 2023
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SUB183557
Created by
admin on Sat Dec 16 12:07:16 UTC 2023 , Edited by admin on Sat Dec 16 12:07:16 UTC 2023
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PRIMARY | |||
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DBSALT001982
Created by
admin on Sat Dec 16 12:07:16 UTC 2023 , Edited by admin on Sat Dec 16 12:07:16 UTC 2023
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PRIMARY | |||
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41AX9SJ8KO
Created by
admin on Sat Dec 16 12:07:16 UTC 2023 , Edited by admin on Sat Dec 16 12:07:16 UTC 2023
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PRIMARY | |||
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DTXSID301027866
Created by
admin on Sat Dec 16 12:07:16 UTC 2023 , Edited by admin on Sat Dec 16 12:07:16 UTC 2023
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PRIMARY | |||
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1859053-21-6
Created by
admin on Sat Dec 16 12:07:16 UTC 2023 , Edited by admin on Sat Dec 16 12:07:16 UTC 2023
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PRIMARY | |||
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m11980
Created by
admin on Sat Dec 16 12:07:16 UTC 2023 , Edited by admin on Sat Dec 16 12:07:16 UTC 2023
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41AX9SJ8KO
Created by
admin on Sat Dec 16 12:07:16 UTC 2023 , Edited by admin on Sat Dec 16 12:07:16 UTC 2023
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PRIMARY | |||
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C131178
Created by
admin on Sat Dec 16 12:07:16 UTC 2023 , Edited by admin on Sat Dec 16 12:07:16 UTC 2023
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PRIMARY | |||
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1327258-57-0
Created by
admin on Sat Dec 16 12:07:16 UTC 2023 , Edited by admin on Sat Dec 16 12:07:16 UTC 2023
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NON-SPECIFIC STOICHIOMETRY | |||
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134692
Created by
admin on Sat Dec 16 12:07:16 UTC 2023 , Edited by admin on Sat Dec 16 12:07:16 UTC 2023
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121490161
Created by
admin on Sat Dec 16 12:07:16 UTC 2023 , Edited by admin on Sat Dec 16 12:07:16 UTC 2023
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DE-120
Created by
admin on Sat Dec 16 12:07:16 UTC 2023 , Edited by admin on Sat Dec 16 12:07:16 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |