Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C16H17ClN2OS.ClH.H2O |
Molecular Weight | 375.313 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
O.Cl.ClC1=CC=CC2=C1SC(=C2)C(=O)N[C@H]3CN4CCC3CC4
InChI
InChIKey=OYFJBYJMAHEUQV-GXKRWWSZSA-N
InChI=1S/C16H17ClN2OS.ClH.H2O/c17-12-3-1-2-11-8-14(21-15(11)12)16(20)18-13-9-19-6-4-10(13)5-7-19;;/h1-3,8,10,13H,4-7,9H2,(H,18,20);1H;1H2/t13-;;/m0../s1
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 |
Molecular Formula | C16H17ClN2OS |
Molecular Weight | 320.837 |
Charge | 0 |
Count |
|
Stereochemistry | ABSOLUTE |
Additional Stereochemistry | No |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Optical Activity | UNSPECIFIED |
Molecular Formula | H2O |
Molecular Weight | 18.0153 |
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
Sat Dec 16 08:03:04 UTC 2023
by
admin
on
Sat Dec 16 08:03:04 UTC 2023
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Record UNII |
9201D24ZB5
|
Record Status |
Validated (UNII)
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Record Version |
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-
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300000042514
Created by
admin on Sat Dec 16 08:03:04 UTC 2023 , Edited by admin on Sat Dec 16 08:03:04 UTC 2023
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PRIMARY | |||
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9201D24ZB5
Created by
admin on Sat Dec 16 08:03:04 UTC 2023 , Edited by admin on Sat Dec 16 08:03:04 UTC 2023
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PRIMARY | |||
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54597188
Created by
admin on Sat Dec 16 08:03:04 UTC 2023 , Edited by admin on Sat Dec 16 08:03:04 UTC 2023
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1350343-61-1
Created by
admin on Sat Dec 16 08:03:04 UTC 2023 , Edited by admin on Sat Dec 16 08:03:04 UTC 2023
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PRIMARY |
Related Record | Type | Details | ||
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ANHYDROUS->SOLVATE |
Related Record | Type | Details | ||
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ACTIVE MOIETY |
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