Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C19H21F3N4O3S |
| Molecular Weight | 442.455 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC1=C(SC(NC(=O)N2CCC[C@H]2C(O)=O)=N1)C3=CC=NC(=C3)C(C)(C)C(F)(F)F
InChI
InChIKey=ZFOZUOSYVNYMPT-LBPRGKRZSA-N
InChI=1S/C19H21F3N4O3S/c1-10-14(11-6-7-23-13(9-11)18(2,3)19(20,21)22)30-16(24-10)25-17(29)26-8-4-5-12(26)15(27)28/h6-7,9,12H,4-5,8H2,1-3H3,(H,27,28)(H,24,25,29)/t12-/m0/s1
| Molecular Formula | C19H21F3N4O3S |
| Molecular Weight | 442.455 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 11:29:25 UTC 2023
by
admin
on
Sat Dec 16 11:29:25 UTC 2023
|
| Record UNII |
783V5Z8EJM
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
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Common Name | English | ||
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Systematic Name | English | ||
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Code | English |
| Code System | Code | Type | Description | ||
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131842331
Created by
admin on Sat Dec 16 11:29:25 UTC 2023 , Edited by admin on Sat Dec 16 11:29:25 UTC 2023
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PRIMARY | |||
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783V5Z8EJM
Created by
admin on Sat Dec 16 11:29:25 UTC 2023 , Edited by admin on Sat Dec 16 11:29:25 UTC 2023
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE |
MAJOR
FECAL; PLASMA; URINE
|
