Details
Stereochemistry | ACHIRAL |
Molecular Formula | C17H26N4S2.2C4H4O4 |
Molecular Weight | 582.689 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 2 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.OC(=O)\C=C/C(O)=O.CC1=NC(C)=C(CCCCN2CCN(CC2)C3=NC(C)=CS3)S1
InChI
InChIKey=XTAMWKMFVOFXOC-SPIKMXEPSA-N
InChI=1S/C17H26N4S2.2C4H4O4/c1-13-12-22-17(18-13)21-10-8-20(9-11-21)7-5-4-6-16-14(2)19-15(3)23-16;2*5-3(6)1-2-4(7)8/h12H,4-11H2,1-3H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-
Molecular Formula | C17H26N4S2 |
Molecular Weight | 350.545 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C4H4O4 |
Molecular Weight | 116.0722 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Optical Activity | NONE |
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 18:58:15 GMT 2023
by
admin
on
Fri Dec 15 18:58:15 GMT 2023
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Record UNII |
52G3OE1G9I
|
Record Status |
Validated (UNII)
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Record Version |
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-
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71587101
Created by
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29953-55-7
Created by
admin on Fri Dec 15 18:58:16 GMT 2023 , Edited by admin on Fri Dec 15 18:58:16 GMT 2023
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PRIMARY | |||
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52G3OE1G9I
Created by
admin on Fri Dec 15 18:58:16 GMT 2023 , Edited by admin on Fri Dec 15 18:58:16 GMT 2023
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PRIMARY |
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE |
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ACTIVE MOIETY |