Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C19H27ClN4O4S |
| Molecular Weight | 442.96 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
CN1C(CCCC(O)=O)=NC2=C1C=CC(=C2)N(CCCl)CCSC[C@H](N)C(O)=O
InChI
InChIKey=RNESDNSXCCJHDL-AWEZNQCLSA-N
InChI=1S/C19H27ClN4O4S/c1-23-16-6-5-13(11-15(16)22-17(23)3-2-4-18(25)26)24(8-7-20)9-10-29-12-14(21)19(27)28/h5-6,11,14H,2-4,7-10,12,21H2,1H3,(H,25,26)(H,27,28)/t14-/m0/s1
| Molecular Formula | C19H27ClN4O4S |
| Molecular Weight | 442.96 |
| 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
Mon Mar 31 22:43:33 GMT 2025
by
admin
on
Mon Mar 31 22:43:33 GMT 2025
|
| Record UNII |
RA9E4M2LKL
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
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Preferred Name | English |
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RA9E4M2LKL
Created by
admin on Mon Mar 31 22:43:33 GMT 2025 , Edited by admin on Mon Mar 31 22:43:33 GMT 2025
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156028090
Created by
admin on Mon Mar 31 22:43:33 GMT 2025 , Edited by admin on Mon Mar 31 22:43:33 GMT 2025
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862510-72-3
Created by
admin on Mon Mar 31 22:43:33 GMT 2025 , Edited by admin on Mon Mar 31 22:43:33 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> METABOLITE |