Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C18H16ClFN4O2 |
| Molecular Weight | 374.7973 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
c1cc(c(cc1Nc2c3cc(c(cc3ncn2)O[C@@]4([H])CCOC4)N)Cl)F
InChI
InChIKey=BIQABKFYKJRXII-NSHDSACASA-N
InChI=1S/C18H16ClFN4O2/c19-13-5-10(1-2-14(13)20)24-18-12-6-15(21)17(7-16(12)22-9-23-18)26-11-3-4-25-8-11/h1-2,5-7,9,11H,3-4,8,21H2,(H,22,23,24)/t11-/m0/s1
| Molecular Formula | C18H16ClFN4O2 |
| Molecular Weight | 374.7973 |
| 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 Jun 26 15:41:21 UTC 2021
by
admin
on
Sat Jun 26 15:41:21 UTC 2021
|
| Record UNII |
Q58L53U44Y
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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314771-76-1
Created by
admin on Sat Jun 26 15:41:21 UTC 2021 , Edited by admin on Sat Jun 26 15:41:21 UTC 2021
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PRIMARY | |||
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Q58L53U44Y
Created by
admin on Sat Jun 26 15:41:21 UTC 2021 , Edited by admin on Sat Jun 26 15:41:21 UTC 2021
|
PRIMARY | |||
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314771-76-1
Created by
admin on Sat Jun 26 15:41:21 UTC 2021 , Edited by admin on Sat Jun 26 15:41:21 UTC 2021
|
PRIMARY | |||
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15606392
Created by
admin on Sat Jun 26 15:41:21 UTC 2021 , Edited by admin on Sat Jun 26 15:41:21 UTC 2021
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
PARENT -> METABOLITE |
minor metabolite
MINOR
URINE
|
