Details
Stereochemistry | ACHIRAL |
Molecular Formula | 2C16H15N2O3S.Mg |
Molecular Weight | 655.039 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
[Mg++].CC(C)COC1=C(C=C(C=C1)C2=NC(C)=C(S2)C([O-])=O)C#N.CC(C)COC3=C(C=C(C=C3)C4=NC(C)=C(S4)C([O-])=O)C#N
InChI
InChIKey=BNABHEFFEDHWIR-UHFFFAOYSA-L
InChI=1S/2C16H16N2O3S.Mg/c2*1-9(2)8-21-13-5-4-11(6-12(13)7-17)15-18-10(3)14(22-15)16(19)20;/h2*4-6,9H,8H2,1-3H3,(H,19,20);/q;;+2/p-2
Molecular Formula | C16H15N2O3S |
Molecular Weight | 315.367 |
Charge | -1 |
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
Sat Dec 16 14:31:28 UTC 2023
by
admin
on
Sat Dec 16 14:31:28 UTC 2023
|
Record UNII |
4UB2J8Q7HG
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Record Status |
Validated (UNII)
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Record Version |
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-
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141336381
Created by
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1456533-39-3
Created by
admin on Sat Dec 16 14:31:28 UTC 2023 , Edited by admin on Sat Dec 16 14:31:28 UTC 2023
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4UB2J8Q7HG
Created by
admin on Sat Dec 16 14:31:28 UTC 2023 , Edited by admin on Sat Dec 16 14:31:28 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
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Related Record | Type | Details | ||
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ACTIVE MOIETY |
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Name | Property Type | Amount | Referenced Substance | Defining | Parameters | References |
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Biological Half-life | PHARMACOKINETIC |
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Volume of Distribution | PHARMACOKINETIC |
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