Details
| Stereochemistry | ACHIRAL |
| Molecular Formula | C17H19ClN2S.C4H4O4 |
| Molecular Weight | 434.936 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.CN(C)CCCN1C2=CC=CC=C2SC3=C1C=C(Cl)C=C3
InChI
InChIKey=SREBWYZNQRYUHE-BTJKTKAUSA-N
InChI=1S/C17H19ClN2S.C4H4O4/c1-19(2)10-5-11-20-14-6-3-4-7-16(14)21-17-9-8-13(18)12-15(17)20;5-3(6)1-2-4(7)8/h3-4,6-9,12H,5,10-11H2,1-2H3;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 | C17H19ClN2S |
| Molecular Weight | 318.864 |
| 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
Mon Mar 31 20:12:16 GMT 2025
by
admin
on
Mon Mar 31 20:12:16 GMT 2025
|
| Record UNII |
Q98X428KKM
|
| Record Status |
Validated (UNII)
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| Record Version |
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16639-82-0
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SUB01256MIG
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100000084739
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Q98X428KKM
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46044
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admin on Mon Mar 31 20:12:16 GMT 2025 , Edited by admin on Mon Mar 31 20:12:16 GMT 2025
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5355848
Created by
admin on Mon Mar 31 20:12:16 GMT 2025 , Edited by admin on Mon Mar 31 20:12:16 GMT 2025
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PARENT -> SALT/SOLVATE |