Details
Stereochemistry | ACHIRAL |
Molecular Formula | C22H32N4O5S.C4H4O4 |
Molecular Weight | 580.65 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.COC1=CC(OC)=C(C=C1OC)C(=O)NC2=NC(=CS2)C(=O)NCCN(C(C)C)C(C)C
InChI
InChIKey=YKSFNGAJFVKGIY-BTJKTKAUSA-N
InChI=1S/C22H32N4O5S.C4H4O4/c1-13(2)26(14(3)4)9-8-23-21(28)16-12-32-22(24-16)25-20(27)15-10-18(30-6)19(31-7)11-17(15)29-5;5-3(6)1-2-4(7)8/h10-14H,8-9H2,1-7H3,(H,23,28)(H,24,25,27);1-2H,(H,5,6)(H,7,8)/b;2-1-
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 |
Molecular Formula | C22H32N4O5S |
Molecular Weight | 464.578 |
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
Sat Dec 16 19:46:08 GMT 2023
by
admin
on
Sat Dec 16 19:46:08 GMT 2023
|
Record UNII |
734AED4DB7
|
Record Status |
Validated (UNII)
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Record Version |
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-
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88069370
Created by
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185103-81-5
Created by
admin on Sat Dec 16 19:46:08 GMT 2023 , Edited by admin on Sat Dec 16 19:46:08 GMT 2023
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734AED4DB7
Created by
admin on Sat Dec 16 19:46:08 GMT 2023 , Edited by admin on Sat Dec 16 19:46:08 GMT 2023
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PRIMARY |
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PARENT -> SALT/SOLVATE |
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