Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C20H23NS.ClH.H2O |
| Molecular Weight | 363.945 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.Cl.CN1CCCC(CC2C3=C(SC4=C2C=CC=C4)C=CC=C3)C1
InChI
InChIKey=RAOHHYUBMJLHNC-UHFFFAOYSA-N
InChI=1S/C20H23NS.ClH.H2O/c1-21-12-6-7-15(14-21)13-18-16-8-2-4-10-19(16)22-20-11-5-3-9-17(18)20;;/h2-5,8-11,15,18H,6-7,12-14H2,1H3;1H;1H2
| Molecular Formula | ClH |
| Molecular Weight | 36.461 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | H2O |
| Molecular Weight | 18.0153 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| Molecular Formula | C20H23NS |
| Molecular Weight | 309.468 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:05:10 UTC 2023
by
admin
on
Fri Dec 15 15:05:10 UTC 2023
|
| Record UNII |
84L8XK6N1G
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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| Classification Tree | Code System | Code | ||
|---|---|---|---|---|
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NCI_THESAURUS |
C66880
Created by
admin on Fri Dec 15 15:05:10 UTC 2023 , Edited by admin on Fri Dec 15 15:05:10 UTC 2023
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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C66115
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SUB03268MIG
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84L8XK6N1G
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DBSALT000602
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100000087592
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78194
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71177
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CHEMBL1201342
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51025
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DTXSID00991080
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m7321
Created by
admin on Fri Dec 15 15:05:10 UTC 2023 , Edited by admin on Fri Dec 15 15:05:10 UTC 2023
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PRIMARY | Merck Index | ||
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258230
Created by
admin on Fri Dec 15 15:05:10 UTC 2023 , Edited by admin on Fri Dec 15 15:05:10 UTC 2023
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7081-40-5
Created by
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C005111
Created by
admin on Fri Dec 15 15:05:10 UTC 2023 , Edited by admin on Fri Dec 15 15:05:10 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
ANHYDROUS->SOLVATE | |||
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PARENT -> SALT/SOLVATE |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |