Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C20H23NO3S.ClH |
| Molecular Weight | 393.927 |
| Optical Activity | UNSPECIFIED |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.[H][C@@]12CCC3=CC(O)=C(OC(C)=O)C=C3[C@@]1([H])C4=C(CN2)SC(CCC)=C4
InChI
InChIKey=HSDYHQNJJMVGFB-PXPMWPIZSA-N
InChI=1S/C20H23NO3S.ClH/c1-3-4-13-8-15-19(25-13)10-21-16-6-5-12-7-17(23)18(24-11(2)22)9-14(12)20(15)16;/h7-9,16,20-21,23H,3-6,10H2,1-2H3;1H/t16-,20+;/m1./s1
| Molecular Formula | C20H23NO3S |
| Molecular Weight | 357.467 |
| Charge | 0 |
| Count |
|
| Stereochemistry | ABSOLUTE |
| Additional Stereochemistry | No |
| Defined Stereocenters | 2 / 2 |
| E/Z Centers | 0 |
| Optical Activity | UNSPECIFIED |
| Molecular Formula | ClH |
| Molecular Weight | 36.461 |
| 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 15:55:06 UTC 2023
by
admin
on
Fri Dec 15 15:55:06 UTC 2023
|
| Record UNII |
NJE3H3EXJ1
|
| Record Status |
Validated (UNII)
|
| Record Version |
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-
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NJE3H3EXJ1
Created by
admin on Fri Dec 15 15:55:06 UTC 2023 , Edited by admin on Fri Dec 15 15:55:06 UTC 2023
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131842170
Created by
admin on Fri Dec 15 15:55:06 UTC 2023 , Edited by admin on Fri Dec 15 15:55:06 UTC 2023
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE |
| Related Record | Type | Details | ||
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PARENT -> IMPURITY |
