Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C13H14N2O2S.ClH.H2O |
| Molecular Weight | 316.804 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
O.Cl.NCC1=CC=C(C=C1)S(=O)(=O)C2=CC=C(N)C=C2
InChI
InChIKey=ZZSVKWWBOXOFRT-UHFFFAOYSA-N
InChI=1S/C13H14N2O2S.ClH.H2O/c14-9-10-1-5-12(6-2-10)18(16,17)13-7-3-11(15)4-8-13;;/h1-8H,9,14-15H2;1H;1H2
| Molecular Formula | C13H14N2O2S |
| Molecular Weight | 262.327 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
| 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 |
Approval Year
| Substance Class |
Chemical
Created
by
admin
on
Edited
Sat Dec 16 09:49:31 GMT 2023
by
admin
on
Sat Dec 16 09:49:31 GMT 2023
|
| Record UNII |
W5S67Z37P4
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
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Common Name | English |
| Code System | Code | Type | Description | ||
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W5S67Z37P4
Created by
admin on Sat Dec 16 09:49:31 GMT 2023 , Edited by admin on Sat Dec 16 09:49:31 GMT 2023
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PRIMARY | |||
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90478946
Created by
admin on Sat Dec 16 09:49:31 GMT 2023 , Edited by admin on Sat Dec 16 09:49:31 GMT 2023
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PRIMARY | |||
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m10329
Created by
admin on Sat Dec 16 09:49:31 GMT 2023 , Edited by admin on Sat Dec 16 09:49:31 GMT 2023
|
PRIMARY | Merck Index |
| Related Record | Type | Details | ||
|---|---|---|---|---|
|
ANHYDROUS->SOLVATE |
