Details
Stereochemistry | ACHIRAL |
Molecular Formula | C12H16N2S.C6H8O7 |
Molecular Weight | 412.457 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)CC(O)(CC(O)=O)C(O)=O.CN1CCCN=C1\C=C\C2=C(C)C=CS2
InChI
InChIKey=OLOCXIJVDIVAHH-FXRZFVDSSA-N
InChI=1S/C12H16N2S.C6H8O7/c1-10-6-9-15-11(10)4-5-12-13-7-3-8-14(12)2;7-3(8)1-6(13,5(11)12)2-4(9)10/h4-6,9H,3,7-8H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/b5-4+;
Molecular Formula | C12H16N2S |
Molecular Weight | 220.334 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Optical Activity | NONE |
Molecular Formula | C6H8O7 |
Molecular Weight | 192.1235 |
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 04:51:03 UTC 2023
by
admin
on
Sat Dec 16 04:51:03 UTC 2023
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Record UNII |
VC8Z4SS5QX
|
Record Status |
Validated (UNII)
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Record Version |
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-
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5702276
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DTXSID90219780
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admin on Sat Dec 16 04:51:03 UTC 2023 , Edited by admin on Sat Dec 16 04:51:03 UTC 2023
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VC8Z4SS5QX
Created by
admin on Sat Dec 16 04:51:03 UTC 2023 , Edited by admin on Sat Dec 16 04:51:03 UTC 2023
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69525-81-1
Created by
admin on Sat Dec 16 04:51:03 UTC 2023 , Edited by admin on Sat Dec 16 04:51:03 UTC 2023
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300000023775
Created by
admin on Sat Dec 16 04:51:03 UTC 2023 , Edited by admin on Sat Dec 16 04:51:03 UTC 2023
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ACTIVE MOIETY |