Details
Stereochemistry | ACHIRAL |
Molecular Formula | C20H25N3S.2C4H4O4 |
Molecular Weight | 571.642 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 2 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.OC(=O)\C=C/C(O)=O.CN1CCN(CCCN2C3=C(SC4=C2C=CC=C4)C=CC=C3)CC1
InChI
InChIKey=PQDKNYWKLCFCJU-SPIKMXEPSA-N
InChI=1S/C20H25N3S.2C4H4O4/c1-21-13-15-22(16-14-21)11-6-12-23-17-7-2-4-9-19(17)24-20-10-5-3-8-18(20)23;2*5-3(6)1-2-4(7)8/h2-5,7-10H,6,11-16H2,1H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-
Molecular Formula | C20H25N3S |
Molecular Weight | 339.498 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 0 |
Optical Activity | NONE |
Molecular Formula | C4H4O4 |
Molecular Weight | 116.0722 |
Charge | 0 |
Count |
|
Stereochemistry | ACHIRAL |
Additional Stereochemistry | No |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Optical Activity | NONE |
Approval Year
Substance Class |
Chemical
Created
by
admin
on
Edited
Fri Dec 15 16:59:01 UTC 2023
by
admin
on
Fri Dec 15 16:59:01 UTC 2023
|
Record UNII |
3VG1507988
|
Record Status |
Validated (UNII)
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Record Version |
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-
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100000079420
Created by
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5282417
Created by
admin on Fri Dec 15 16:59:01 UTC 2023 , Edited by admin on Fri Dec 15 16:59:01 UTC 2023
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14516-56-4
Created by
admin on Fri Dec 15 16:59:01 UTC 2023 , Edited by admin on Fri Dec 15 16:59:01 UTC 2023
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SUB14812MIG
Created by
admin on Fri Dec 15 16:59:01 UTC 2023 , Edited by admin on Fri Dec 15 16:59:01 UTC 2023
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3VG1507988
Created by
admin on Fri Dec 15 16:59:01 UTC 2023 , Edited by admin on Fri Dec 15 16:59:01 UTC 2023
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PRIMARY |
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ACTIVE MOIETY |