Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C18H22BrNO.C7H7ClN4O2 |
| Molecular Weight | 562.886 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CN1C2=C(N=C(Cl)N2)C(=O)N(C)C1=O.CN(C)CCO[C@](C)(C3=CC=CC=C3)C4=CC=C(Br)C=C4
InChI
InChIKey=UZJKOLCOUILXEJ-GMUIIQOCSA-N
InChI=1S/C18H22BrNO.C7H7ClN4O2/c1-18(21-14-13-20(2)3,15-7-5-4-6-8-15)16-9-11-17(19)12-10-16;1-11-4-3(9-6(8)10-4)5(13)12(2)7(11)14/h4-12H,13-14H2,1-3H3;1-2H3,(H,9,10)/t18-;/m1./s1
| Molecular Formula | C18H22BrNO |
| Molecular Weight | 348.277 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | C7H7ClN4O2 |
| Molecular Weight | 214.609 |
| 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
Wed Apr 02 13:50:37 GMT 2025
by
admin
on
Wed Apr 02 13:50:37 GMT 2025
|
| Record UNII |
O64U15JWT6
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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Preferred Name | English | ||
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Common Name | English |
| Code System | Code | Type | Description | ||
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O64U15JWT6
Created by
admin on Wed Apr 02 13:50:37 GMT 2025 , Edited by admin on Wed Apr 02 13:50:37 GMT 2025
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PRIMARY | |||
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76968405
Created by
admin on Wed Apr 02 13:50:37 GMT 2025 , Edited by admin on Wed Apr 02 13:50:37 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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RACEMATE -> ENANTIOMER |