Details
Stereochemistry | RACEMIC |
Molecular Formula | C19H25N3O2S2.CH4O3S |
Molecular Weight | 487.656 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CS(O)(=O)=O.CC(CN1C2=CC=CC=C2SC3=C1C=C(C=C3)S(=O)(=O)N(C)C)N(C)C
InChI
InChIKey=JGKVKXPDDVRUKC-UHFFFAOYSA-N
InChI=1S/C19H25N3O2S2.CH4O3S/c1-14(20(2)3)13-22-16-8-6-7-9-18(16)25-19-11-10-15(12-17(19)22)26(23,24)21(4)5;1-5(2,3)4/h6-12,14H,13H2,1-5H3;1H3,(H,2,3,4)
Molecular Formula | C19H25N3O2S2 |
Molecular Weight | 391.551 |
Charge | 0 |
Count |
|
Stereochemistry | RACEMIC |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 1 |
E/Z Centers | 0 |
Optical Activity | ( + / - ) |
Molecular Formula | CH4O3S |
Molecular Weight | 96.106 |
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 17:19:12 UTC 2023
by
admin
on
Fri Dec 15 17:19:12 UTC 2023
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Record UNII |
B28V86NGNK
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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 |
C66885
Created by
admin on Fri Dec 15 17:19:12 UTC 2023 , Edited by admin on Fri Dec 15 17:19:12 UTC 2023
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100000088417
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C80771
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25715
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CHEMBL346977
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DTXSID10927092
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DBSALT002448
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236-041-8
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50139
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7455-39-2
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B28V86NGNK
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m5528
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13115-40-7
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SUB01755MIG
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |