Details
Stereochemistry | ABSOLUTE |
Molecular Formula | C16H21N3O2S.2ClH |
Molecular Weight | 392.344 |
Optical Activity | UNSPECIFIED |
Defined Stereocenters | 1 / 1 |
E/Z Centers | 0 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
Cl.Cl.C[C@@H]1CNCCCCN1S(=O)(=O)C2=CC3=C(C=C2)C=NC=C3
InChI
InChIKey=KSHARUQDBWSRFQ-FFXKMJQXSA-N
InChI=1S/C16H21N3O2S.2ClH/c1-13-11-17-7-2-3-9-19(13)22(20,21)16-5-4-15-12-18-8-6-14(15)10-16;;/h4-6,8,10,12-13,17H,2-3,7,9,11H2,1H3;2*1H/t13-;;/m1../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 | C16H21N3O2S |
Molecular Weight | 319.422 |
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 16:12:14 GMT 2023
by
admin
on
Sat Dec 16 16:12:14 GMT 2023
|
Record UNII |
C2LQV1I5S0
|
Record Status |
Validated (UNII)
|
Record Version |
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-
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C2LQV1I5S0
Created by
admin on Sat Dec 16 16:12:14 GMT 2023 , Edited by admin on Sat Dec 16 16:12:14 GMT 2023
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66727075
Created by
admin on Sat Dec 16 16:12:14 GMT 2023 , Edited by admin on Sat Dec 16 16:12:14 GMT 2023
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1258832-72-2
Created by
admin on Sat Dec 16 16:12:14 GMT 2023 , Edited by admin on Sat Dec 16 16:12:14 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
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PARENT -> SALT/SOLVATE |
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Related Record | Type | Details | ||
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ACTIVE MOIETY |