Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C20H28N2O5S.ClH |
Molecular Weight | 444.973 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.CCOC1=C(OCCN[C@H](C)CC2=CC(=C(OC)C=C2)S(N)(=O)=O)C=CC=C1
InChI
InChIKey=ZZIZZTHXZRDOFM-XFULWGLBSA-N
InChI=1S/C20H28N2O5S.ClH/c1-4-26-17-7-5-6-8-18(17)27-12-11-22-15(2)13-16-9-10-19(25-3)20(14-16)28(21,23)24;/h5-10,14-15,22H,4,11-13H2,1-3H3,(H2,21,23,24);1H/t15-;/m1./s1
Molecular Formula | C20H28N2O5S |
Molecular Weight | 408.512 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
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
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 16:35:37 UTC 2023
by
admin
on
Fri Dec 15 16:35:37 UTC 2023
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Record UNII |
11SV1951MR
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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 |
C29713
Created by
admin on Fri Dec 15 16:35:37 UTC 2023 , Edited by admin on Fri Dec 15 16:35:37 UTC 2023
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Code System | Code | Type | Description | ||
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1643260
Created by
admin on Fri Dec 15 16:35:37 UTC 2023 , Edited by admin on Fri Dec 15 16:35:37 UTC 2023
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PRIMARY | |||
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11SV1951MR
Created by
admin on Fri Dec 15 16:35:37 UTC 2023 , Edited by admin on Fri Dec 15 16:35:37 UTC 2023
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PRIMARY | |||
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9399
Created by
admin on Fri Dec 15 16:35:37 UTC 2023 , Edited by admin on Fri Dec 15 16:35:37 UTC 2023
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PRIMARY | |||
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DTXSID2046628
Created by
admin on Fri Dec 15 16:35:37 UTC 2023 , Edited by admin on Fri Dec 15 16:35:37 UTC 2023
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PRIMARY | |||
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m10451
Created by
admin on Fri Dec 15 16:35:37 UTC 2023 , Edited by admin on Fri Dec 15 16:35:37 UTC 2023
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PRIMARY | Merck Index | ||
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11SV1951MR
Created by
admin on Fri Dec 15 16:35:37 UTC 2023 , Edited by admin on Fri Dec 15 16:35:37 UTC 2023
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100000089670
Created by
admin on Fri Dec 15 16:35:37 UTC 2023 , Edited by admin on Fri Dec 15 16:35:37 UTC 2023
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PRIMARY | |||
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C088482
Created by
admin on Fri Dec 15 16:35:37 UTC 2023 , Edited by admin on Fri Dec 15 16:35:37 UTC 2023
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5362376
Created by
admin on Fri Dec 15 16:35:37 UTC 2023 , Edited by admin on Fri Dec 15 16:35:37 UTC 2023
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PRIMARY | |||
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236495
Created by
admin on Fri Dec 15 16:35:37 UTC 2023 , Edited by admin on Fri Dec 15 16:35:37 UTC 2023
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PRIMARY | RxNorm | ||
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DBSALT000978
Created by
admin on Fri Dec 15 16:35:37 UTC 2023 , Edited by admin on Fri Dec 15 16:35:37 UTC 2023
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CHEMBL836
Created by
admin on Fri Dec 15 16:35:37 UTC 2023 , Edited by admin on Fri Dec 15 16:35:37 UTC 2023
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SUB04673MIG
Created by
admin on Fri Dec 15 16:35:37 UTC 2023 , Edited by admin on Fri Dec 15 16:35:37 UTC 2023
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106463-17-6
Created by
admin on Fri Dec 15 16:35:37 UTC 2023 , Edited by admin on Fri Dec 15 16:35:37 UTC 2023
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GG-3
Created by
admin on Fri Dec 15 16:35:37 UTC 2023 , Edited by admin on Fri Dec 15 16:35:37 UTC 2023
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C29486
Created by
admin on Fri Dec 15 16:35:37 UTC 2023 , Edited by admin on Fri Dec 15 16:35:37 UTC 2023
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PRIMARY |
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IMPURITY -> PARENT |
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|
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
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IMPURITY -> PARENT |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
|
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IMPURITY -> PARENT |
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EP
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Related Record | Type | Details | ||
---|---|---|---|---|
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ACTIVE MOIETY |