Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C18H26ClN3O.H2O4S |
| Molecular Weight | 433.95 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OS(O)(=O)=O.CCN(CCO)CCC[C@H](C)NC1=C2C=CC(Cl)=CC2=NC=C1
InChI
InChIKey=JCBIVZZPXRZKTI-UQKRIMTDSA-N
InChI=1S/C18H26ClN3O.H2O4S/c1-3-22(11-12-23)10-4-5-14(2)21-17-8-9-20-18-13-15(19)6-7-16(17)18;1-5(2,3)4/h6-9,13-14,23H,3-5,10-12H2,1-2H3,(H,20,21);(H2,1,2,3,4)/t14-;/m0./s1
| Molecular Formula | C18H26ClN3O |
| Molecular Weight | 335.872 |
| 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
Wed Apr 02 10:25:46 GMT 2025
by
admin
on
Wed Apr 02 10:25:46 GMT 2025
|
| Record UNII |
CP6SX95ATD
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
Download
| Name | Type | Language | ||
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Preferred Name | English | ||
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Common Name | English |
| Code System | Code | Type | Description | ||
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CP6SX95ATD
Created by
admin on Wed Apr 02 10:25:46 GMT 2025 , Edited by admin on Wed Apr 02 10:25:46 GMT 2025
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PRIMARY | |||
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73416235
Created by
admin on Wed Apr 02 10:25:46 GMT 2025 , Edited by admin on Wed Apr 02 10:25:46 GMT 2025
|
PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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RACEMATE -> ENANTIOMER |
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PARENT -> SALT/SOLVATE |
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| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |
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