Details
| Stereochemistry | ABSOLUTE |
| Molecular Formula | C16H16ClNO2S |
| Molecular Weight | 321.822 |
| Optical Activity | ( - ) |
| Defined Stereocenters | 1 / 1 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
COC(=O)[C@H](N1CCC2=C(C1)C=CS2)C3=C(Cl)C=CC=C3
InChI
InChIKey=GKTWGGQPFAXNFI-OAHLLOKOSA-N
InChI=1S/C16H16ClNO2S/c1-20-16(19)15(12-4-2-3-5-13(12)17)18-8-6-14-11(10-18)7-9-21-14/h2-5,7,9,15H,6,8,10H2,1H3/t15-/m1/s1
| Molecular Formula | C16H16ClNO2S |
| Molecular Weight | 321.822 |
| 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
Sat Dec 16 18:34:10 UTC 2023
by
admin
on
Sat Dec 16 18:34:10 UTC 2023
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| Record UNII |
295YY352H3
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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120202-69-9
Created by
admin on Sat Dec 16 18:34:10 UTC 2023 , Edited by admin on Sat Dec 16 18:34:10 UTC 2023
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295YY352H3
Created by
admin on Sat Dec 16 18:34:10 UTC 2023 , Edited by admin on Sat Dec 16 18:34:10 UTC 2023
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667556
Created by
admin on Sat Dec 16 18:34:10 UTC 2023 , Edited by admin on Sat Dec 16 18:34:10 UTC 2023
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| Related Record | Type | Details | ||
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SALT/SOLVATE -> PARENT |
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| Related Record | Type | Details | ||
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PARENT -> IMPURITY |
CHROMATOGRAPHIC PURITY (HPLC/UV)
EP
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PARENT -> IMPURITY |
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