Details
Stereochemistry | RACEMIC |
Molecular Formula | C19H22FN3O4.CH4O3S |
Molecular Weight | 471.5 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
Stereo Comments | C19H22FN3O4 |
SHOW SMILES / InChI
SMILES
CS(O)(=O)=O.COC1=C(N2CCNC(C)C2)C(F)=CC3=C1N(C=C(C(O)=O)C3=O)C4CC4
InChI
InChIKey=PMMNVFFMFJMFDB-UHFFFAOYSA-N
InChI=1S/C19H22FN3O4.CH4O3S/c1-10-8-22(6-5-21-10)16-14(20)7-12-15(18(16)27-2)23(11-3-4-11)9-13(17(12)24)19(25)26;1-5(2,3)4/h7,9-11,21H,3-6,8H2,1-2H3,(H,25,26);1H3,(H,2,3,4)
Molecular Formula | CH4O3S |
Molecular Weight | 96.106 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C19H22FN3O4 |
Molecular Weight | 375.3941 |
Charge | 0 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Optical Activity | ( + / - ) |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 10:28:48 UTC 2023
by
admin
on
Sat Dec 16 10:28:48 UTC 2023
|
Record UNII |
NZE1V6L7F9
|
Record Status |
Validated (UNII)
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Record Version |
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-
Download
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Common Name | English | ||
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Systematic Name | English |
Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C795
Created by
admin on Sat Dec 16 10:28:48 UTC 2023 , Edited by admin on Sat Dec 16 10:28:48 UTC 2023
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Code System | Code | Type | Description | ||
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316819-28-0
Created by
admin on Sat Dec 16 10:28:48 UTC 2023 , Edited by admin on Sat Dec 16 10:28:48 UTC 2023
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PRIMARY | |||
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SUB130614
Created by
admin on Sat Dec 16 10:28:48 UTC 2023 , Edited by admin on Sat Dec 16 10:28:48 UTC 2023
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NZE1V6L7F9
Created by
admin on Sat Dec 16 10:28:48 UTC 2023 , Edited by admin on Sat Dec 16 10:28:48 UTC 2023
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C132281
Created by
admin on Sat Dec 16 10:28:48 UTC 2023 , Edited by admin on Sat Dec 16 10:28:48 UTC 2023
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DTXSID60581345
Created by
admin on Sat Dec 16 10:28:48 UTC 2023 , Edited by admin on Sat Dec 16 10:28:48 UTC 2023
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100000156682
Created by
admin on Sat Dec 16 10:28:48 UTC 2023 , Edited by admin on Sat Dec 16 10:28:48 UTC 2023
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16040196
Created by
admin on Sat Dec 16 10:28:48 UTC 2023 , Edited by admin on Sat Dec 16 10:28:48 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 |