Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C23H32N6O3S.2ClH |
| Molecular Weight | 545.525 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.Cl.CN1C2=C(N(CC(O)CN3CCN(CCCSC4=CC=CC=C4)CC3)C=N2)C(=O)N(C)C1=O
InChI
InChIKey=HFYFNZKRWQJSLF-UHFFFAOYSA-N
InChI=1S/C23H32N6O3S.2ClH/c1-25-21-20(22(31)26(2)23(25)32)29(17-24-21)16-18(30)15-28-12-10-27(11-13-28)9-6-14-33-19-7-4-3-5-8-19;;/h3-5,7-8,17-18,30H,6,9-16H2,1-2H3;2*1H
| Molecular Formula | C23H32N6O3S |
| Molecular Weight | 472.604 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
| 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 |
Approval Year
Targets
| Primary Target | Pharmacology | Condition | Potency |
|---|---|---|---|
Target ID: P35367 Gene ID: 3269.0 Gene Symbol: HRH1 Target Organism: Homo sapiens (Human) Sources: https://www.ncbi.nlm.nih.gov/pubmed/2424463 |
| Substance Class |
Chemical
Created
by
admin
on
Edited
Mon Mar 31 19:14:53 GMT 2025
by
admin
on
Mon Mar 31 19:14:53 GMT 2025
|
| Record UNII |
409R6U6UEI
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
Download
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Preferred Name | English | ||
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| Classification Tree | Code System | Code | ||
|---|---|---|---|---|
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NCI_THESAURUS |
C29578
Created by
admin on Mon Mar 31 19:14:53 GMT 2025 , Edited by admin on Mon Mar 31 19:14:53 GMT 2025
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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300000055276
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409R6U6UEI
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admin on Mon Mar 31 19:14:53 GMT 2025 , Edited by admin on Mon Mar 31 19:14:53 GMT 2025
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79712-53-1
Created by
admin on Mon Mar 31 19:14:53 GMT 2025 , Edited by admin on Mon Mar 31 19:14:53 GMT 2025
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CHEMBL155962
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admin on Mon Mar 31 19:14:53 GMT 2025 , Edited by admin on Mon Mar 31 19:14:53 GMT 2025
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6918044
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admin on Mon Mar 31 19:14:53 GMT 2025 , Edited by admin on Mon Mar 31 19:14:53 GMT 2025
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DTXSID701000684
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W-18
Created by
admin on Mon Mar 31 19:14:53 GMT 2025 , Edited by admin on Mon Mar 31 19:14:53 GMT 2025
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C96197
Created by
admin on Mon Mar 31 19:14:53 GMT 2025 , Edited by admin on Mon Mar 31 19:14:53 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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ACTIVE MOIETY |