Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C17H18FN3O3.H2O4S |
| Molecular Weight | 429.42 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OS(O)(=O)=O.OC(=O)C1=CN(C2CC2)C3=CC(N4CCNCC4)=C(F)C=C3C1=O
InChI
InChIKey=DQDUDUWTGSTECF-UHFFFAOYSA-N
InChI=1S/C17H18FN3O3.H2O4S/c18-13-7-11-14(8-15(13)20-5-3-19-4-6-20)21(10-1-2-10)9-12(16(11)22)17(23)24;1-5(2,3)4/h7-10,19H,1-6H2,(H,23,24);(H2,1,2,3,4)
| Molecular Formula | C17H18FN3O3 |
| Molecular Weight | 331.3415 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | H2O4S |
| Molecular Weight | 98.078 |
| 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 19:22:03 UTC 2023
by
admin
on
Sat Dec 16 19:22:03 UTC 2023
|
| Record UNII |
EQ65GND522
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
Download
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Systematic Name | English |
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104786-85-8
Created by
admin on Sat Dec 16 19:22:03 UTC 2023 , Edited by admin on Sat Dec 16 19:22:03 UTC 2023
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NON-SPECIFIC STOICHIOMETRY | |||
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EQ65GND522
Created by
admin on Sat Dec 16 19:22:03 UTC 2023 , Edited by admin on Sat Dec 16 19:22:03 UTC 2023
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PRIMARY | |||
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69533050
Created by
admin on Sat Dec 16 19:22:03 UTC 2023 , Edited by admin on Sat Dec 16 19:22:03 UTC 2023
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PRIMARY | |||
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853268-20-9
Created by
admin on Sat Dec 16 19:22:03 UTC 2023 , Edited by admin on Sat Dec 16 19:22:03 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
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ACTIVE MOIETY |
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