Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C25H29N3O4S.ClH |
| Molecular Weight | 504.041 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CS(=O)(=O)NC1=CC=C2OC3(CCN(CC3)[C@@H]4CCC5=CC(=CC=C5C4)C#N)C[C@@H](O)C2=C1
InChI
InChIKey=XEISGCQFKBFQOQ-BLDCTAJRSA-N
InChI=1S/C25H29N3O4S.ClH/c1-33(30,31)27-20-5-7-24-22(14-20)23(29)15-25(32-24)8-10-28(11-9-25)21-6-4-18-12-17(16-26)2-3-19(18)13-21;/h2-3,5,7,12,14,21,23,27,29H,4,6,8-11,13,15H2,1H3;1H/t21-,23-;/m1./s1
| 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 | C25H29N3O4S |
| Molecular Weight | 467.58 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Tue Apr 01 21:11:04 GMT 2025
by
admin
on
Tue Apr 01 21:11:04 GMT 2025
|
| Record UNII |
S8SBT92MD6
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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S8SBT92MD6
Created by
admin on Tue Apr 01 21:11:04 GMT 2025 , Edited by admin on Tue Apr 01 21:11:04 GMT 2025
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PRIMARY | |||
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129660494
Created by
admin on Tue Apr 01 21:11:04 GMT 2025 , Edited by admin on Tue Apr 01 21:11:04 GMT 2025
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156619-48-6
Created by
admin on Tue Apr 01 21:11:04 GMT 2025 , Edited by admin on Tue Apr 01 21:11:04 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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SOLVATE->ANHYDROUS | |||
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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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