Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C31H35Cl2F6N3O3 |
| Molecular Weight | 682.524 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(C)(C1CCN(CC[C@]2(CN(CCO2)C(=O)CC3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F)C4=CC=C(Cl)C(Cl)=C4)CC1)C(N)=O
InChI
InChIKey=ZLNYUCXXSDDIFU-LJAQVGFWSA-N
InChI=1S/C31H35Cl2F6N3O3/c1-28(2,27(40)44)20-5-8-41(9-6-20)10-7-29(21-3-4-24(32)25(33)17-21)18-42(11-12-45-29)26(43)15-19-13-22(30(34,35)36)16-23(14-19)31(37,38)39/h3-4,13-14,16-17,20H,5-12,15,18H2,1-2H3,(H2,40,44)/t29-/m0/s1
| Molecular Formula | C31H35Cl2F6N3O3 |
| Molecular Weight | 682.524 |
| 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 16:20:06 UTC 2023
by
admin
on
Sat Dec 16 16:20:06 UTC 2023
|
| Record UNII |
E35SK332MS
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
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Official Name | English | ||
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Code | English | ||
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Common Name | English | ||
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Systematic Name | English | ||
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Common Name | English |
| Classification Tree | Code System | Code | ||
|---|---|---|---|---|
|
NCI_THESAURUS |
C267
Created by
admin on Sat Dec 16 16:20:06 UTC 2023 , Edited by admin on Sat Dec 16 16:20:06 UTC 2023
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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Burapitant
Created by
admin on Sat Dec 16 16:20:06 UTC 2023 , Edited by admin on Sat Dec 16 16:20:06 UTC 2023
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PRIMARY | |||
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E35SK332MS
Created by
admin on Sat Dec 16 16:20:06 UTC 2023 , Edited by admin on Sat Dec 16 16:20:06 UTC 2023
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PRIMARY | |||
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23649599
Created by
admin on Sat Dec 16 16:20:06 UTC 2023 , Edited by admin on Sat Dec 16 16:20:06 UTC 2023
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PRIMARY | |||
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300000034146
Created by
admin on Sat Dec 16 16:20:06 UTC 2023 , Edited by admin on Sat Dec 16 16:20:06 UTC 2023
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PRIMARY | |||
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299427-93-3
Created by
admin on Sat Dec 16 16:20:06 UTC 2023 , Edited by admin on Sat Dec 16 16:20:06 UTC 2023
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NON-SPECIFIC STEREOCHEMISTRY | |||
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DTXSID10968465
Created by
admin on Sat Dec 16 16:20:06 UTC 2023 , Edited by admin on Sat Dec 16 16:20:06 UTC 2023
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PRIMARY | |||
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CHEMBL3544947
Created by
admin on Sat Dec 16 16:20:06 UTC 2023 , Edited by admin on Sat Dec 16 16:20:06 UTC 2023
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PRIMARY | |||
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9138
Created by
admin on Sat Dec 16 16:20:06 UTC 2023 , Edited by admin on Sat Dec 16 16:20:06 UTC 2023
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PRIMARY | |||
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C90718
Created by
admin on Sat Dec 16 16:20:06 UTC 2023 , Edited by admin on Sat Dec 16 16:20:06 UTC 2023
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PRIMARY | |||
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537034-22-3
Created by
admin on Sat Dec 16 16:20:06 UTC 2023 , Edited by admin on Sat Dec 16 16:20:06 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
