Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C18H26ClN3.H2O4S |
| Molecular Weight | 417.951 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OS(O)(=O)=O.CCN(CC)CCC[C@H](C)NC1=C2C=CC(Cl)=CC2=NC=C1
InChI
InChIKey=OJPWHUOVKVKBQB-UQKRIMTDSA-N
InChI=1S/C18H26ClN3.H2O4S/c1-4-22(5-2)12-6-7-14(3)21-17-10-11-20-18-13-15(19)8-9-16(17)18;1-5(2,3)4/h8-11,13-14H,4-7,12H2,1-3H3,(H,20,21);(H2,1,2,3,4)/t14-;/m0./s1
| Molecular Formula | C18H26ClN3 |
| Molecular Weight | 319.872 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| 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
Mon Mar 31 23:09:07 GMT 2025
by
admin
on
Mon Mar 31 23:09:07 GMT 2025
|
| Record UNII |
8RSH28F7OS
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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Common Name | English | ||
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Preferred Name | English |
| Code System | Code | Type | Description | ||
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76958844
Created by
admin on Mon Mar 31 23:09:07 GMT 2025 , Edited by admin on Mon Mar 31 23:09:07 GMT 2025
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PRIMARY | |||
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8RSH28F7OS
Created by
admin on Mon Mar 31 23:09:07 GMT 2025 , Edited by admin on Mon Mar 31 23:09:07 GMT 2025
|
PRIMARY |
| Related Record | Type | Details | ||
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RACEMATE -> ENANTIOMER |
