Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C22H26ClFN2O5S.C6H14N4O2 |
Molecular Weight | 659.17 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 3 / 3 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
N[C@@H](CCCNC(N)=N)C(O)=O.C[C@H]1CN([C@H](C)CN1CC2=CC=C(F)C=C2)C(=O)COC3=C(CS(O)(=O)=O)C=C(Cl)C=C3
InChI
InChIKey=YDCPKICEZNHJHA-SHUTYENTSA-N
InChI=1S/C22H26ClFN2O5S.C6H14N4O2/c1-15-11-26(16(2)10-25(15)12-17-3-6-20(24)7-4-17)22(27)13-31-21-8-5-19(23)9-18(21)14-32(28,29)30;7-4(5(11)12)2-1-3-10-6(8)9/h3-9,15-16H,10-14H2,1-2H3,(H,28,29,30);4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t15-,16+;4-/m00/s1
Molecular Formula | C22H26ClFN2O5S |
Molecular Weight | 484.969 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 2 / 2 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | C6H14N4O2 |
Molecular Weight | 174.201 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 15:37:17 UTC 2023
by
admin
on
Fri Dec 15 15:37:17 UTC 2023
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Record UNII |
HVU9ALU1GL
|
Record Status |
Validated (UNII)
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Record Version |
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-
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HVU9ALU1GL
Created by
admin on Fri Dec 15 15:37:17 UTC 2023 , Edited by admin on Fri Dec 15 15:37:17 UTC 2023
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11262338
Created by
admin on Fri Dec 15 15:37:17 UTC 2023 , Edited by admin on Fri Dec 15 15:37:17 UTC 2023
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813446-39-8
Created by
admin on Fri Dec 15 15:37:17 UTC 2023 , Edited by admin on Fri Dec 15 15:37:17 UTC 2023
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE |