Details
Stereochemistry | ACHIRAL |
Molecular Formula | C23H28ClN3O2S.2C4H4O4 |
Molecular Weight | 678.15 |
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.CC(=O)OCCN1CCN(CCCN2C3=C(SC4=C2C=C(Cl)C=C4)C=CC=C3)CC1
InChI
InChIKey=CRSLVYHPQPAICF-SPIKMXEPSA-N
InChI=1S/C23H28ClN3O2S.2C4H4O4/c1-18(28)29-16-15-26-13-11-25(12-14-26)9-4-10-27-20-5-2-3-6-22(20)30-23-8-7-19(24)17-21(23)27;2*5-3(6)1-2-4(7)8/h2-3,5-8,17H,4,9-16H2,1H3;2*1-2H,(H,5,6)(H,7,8)/b;2*2-1-
Molecular Formula | C23H28ClN3O2S |
Molecular Weight | 446.005 |
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
Sat Dec 16 10:47:54 GMT 2023
by
admin
on
Sat Dec 16 10:47:54 GMT 2023
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Record UNII |
ZI73U93388
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Record Status |
Validated (UNII)
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Record Version |
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-
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71954679
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admin on Sat Dec 16 10:47:54 GMT 2023 , Edited by admin on Sat Dec 16 10:47:54 GMT 2023
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