Details
Stereochemistry | RACEMIC |
Molecular Formula | 2C17H18N3O3S.Mg |
Molecular Weight | 713.121 |
Optical Activity | ( + / - ) |
Defined Stereocenters | 0 / 2 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Mg++].COC1=CC2=C([N-]C(=N2)[S+]([O-])CC3=C(C)C(OC)=C(C)C=N3)C=C1.COC4=CC5=C([N-]C(=N5)[S+]([O-])CC6=C(C)C(OC)=C(C)C=N6)C=C4
InChI
InChIKey=KWORUUGOSLYAGD-UHFFFAOYSA-N
InChI=1S/2C17H18N3O3S.Mg/c2*1-10-8-18-15(11(2)16(10)23-4)9-24(21)17-19-13-6-5-12(22-3)7-14(13)20-17;/h2*5-8H,9H2,1-4H3;/q2*-1;+2
Molecular Formula | C17H19N3O3S |
Molecular Weight | 345.416 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | Mg |
Molecular Weight | 24.305 |
Charge | 2 |
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 15:50:41 GMT 2023
by
admin
on
Fri Dec 15 15:50:41 GMT 2023
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Record UNII |
426QFE7XLK
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Record Status |
Validated (UNII)
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Record Version |
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Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C29723
Created by
admin on Fri Dec 15 15:50:41 GMT 2023 , Edited by admin on Fri Dec 15 15:50:41 GMT 2023
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Code System | Code | Type | Description | ||
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MM-27
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130564
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CHEMBL1503
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95382-33-5
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SUB03513MIG
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1478549
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C66256
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m8209
Created by
admin on Fri Dec 15 15:50:41 GMT 2023 , Edited by admin on Fri Dec 15 15:50:41 GMT 2023
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PRIMARY | Merck Index | ||
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DBSALT000131
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426QFE7XLK
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236486
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426QFE7XLK
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100000085918
Created by
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