Details
Stereochemistry | ACHIRAL |
Molecular Formula | C18H21N7O4S.C5H8O3 |
Molecular Weight | 547.584 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
CC(=O)CCC(O)=O.COC1=CC2=NC(=NC(N)=C2C=C1OC)N3CCN(CC3)C(=O)C4=NN=C(O4)SC
InChI
InChIKey=NIDVOMJMOVCWQI-UHFFFAOYSA-N
InChI=1S/C18H21N7O4S.C5H8O3/c1-27-12-8-10-11(9-13(12)28-2)20-17(21-14(10)19)25-6-4-24(5-7-25)16(26)15-22-23-18(29-15)30-3;1-4(6)2-3-5(7)8/h8-9H,4-7H2,1-3H3,(H2,19,20,21);2-3H2,1H3,(H,7,8)
Molecular Formula | C5H8O3 |
Molecular Weight | 116.1152 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C18H21N7O4S |
Molecular Weight | 431.469 |
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
Fri Dec 15 15:00:01 UTC 2023
by
admin
on
Fri Dec 15 15:00:01 UTC 2023
|
Record UNII |
21CC6UVV2J
|
Record Status |
Validated (UNII)
|
Record Version |
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-
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21312538
Created by
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DTXSID20998117
Created by
admin on Fri Dec 15 15:00:01 UTC 2023 , Edited by admin on Fri Dec 15 15:00:01 UTC 2023
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21CC6UVV2J
Created by
admin on Fri Dec 15 15:00:01 UTC 2023 , Edited by admin on Fri Dec 15 15:00:01 UTC 2023
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76798-65-7
Created by
admin on Fri Dec 15 15:00:01 UTC 2023 , Edited by admin on Fri Dec 15 15:00:01 UTC 2023
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Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |