Details
Stereochemistry | ACHIRAL |
Molecular Formula | C21H20N4O.2CH3O4S |
Molecular Weight | 566.604 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
COS([O-])(=O)=O.COS([O-])(=O)=O.C[N+]1=CC=CC2=CC(NC(=O)NC3=CC=C4C(C=CC=[N+]4C)=C3)=CC=C12
InChI
InChIKey=BOMUADPKDXMXIH-UHFFFAOYSA-M
InChI=1S/C21H19N4O.2CH4O4S/c1-24-11-3-5-15-13-17(7-9-19(15)24)22-21(26)23-18-8-10-20-16(14-18)6-4-12-25(20)2;2*1-5-6(2,3)4/h3-14H,1-2H3,(H-,22,23,26);2*1H3,(H,2,3,4)/q+1;;/p-1
Molecular Formula | C21H20N4O |
Molecular Weight | 344.4097 |
Charge | 2 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | CH3O4S |
Molecular Weight | 111.097 |
Charge | -1 |
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 15:17:22 GMT 2023
by
admin
on
Fri Dec 15 15:17:22 GMT 2023
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Record UNII |
DE4G9V3O4A
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Record Status |
Validated (UNII)
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Record Version |
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-
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DE4G9V3O4A
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300000010780
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135-14-8
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DTXSID001033866
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C009154
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m4663
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admin on Fri Dec 15 15:17:22 GMT 2023 , Edited by admin on Fri Dec 15 15:17:22 GMT 2023
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8661
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admin on Fri Dec 15 15:17:22 GMT 2023 , Edited by admin on Fri Dec 15 15:17:22 GMT 2023
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |