Details
Stereochemistry | ACHIRAL |
Molecular Formula | C18H22N2OS.C4H4O4 |
Molecular Weight | 430.517 |
Optical Activity | NONE |
Defined Stereocenters | 0 / 0 |
E/Z Centers | 1 |
Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C/C(O)=O.COC1=CC2=C(SC3=C(C=CC=C3)N2CCCN(C)C)C=C1
InChI
InChIKey=ZWLMLVIUWRUDBD-BTJKTKAUSA-N
InChI=1S/C18H22N2OS.C4H4O4/c1-19(2)11-6-12-20-15-7-4-5-8-17(15)22-18-10-9-14(21-3)13-16(18)20;5-3(6)1-2-4(7)8/h4-5,7-10,13H,6,11-12H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1-
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 |
Molecular Formula | C18H22N2OS |
Molecular Weight | 314.445 |
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
Fri Dec 15 14:57:59 GMT 2023
by
admin
on
Fri Dec 15 14:57:59 GMT 2023
|
Record UNII |
OR0RPY2Y2V
|
Record Status |
Validated (UNII)
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Record Version |
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-
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Code | English | ||
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Common Name | English |
Classification Tree | Code System | Code | ||
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NCI_THESAURUS |
C66883
Created by
admin on Fri Dec 15 14:57:59 GMT 2023 , Edited by admin on Fri Dec 15 14:57:59 GMT 2023
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NCI_THESAURUS |
C66885
Created by
admin on Fri Dec 15 14:57:59 GMT 2023 , Edited by admin on Fri Dec 15 14:57:59 GMT 2023
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Code System | Code | Type | Description | ||
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OR0RPY2Y2V
Created by
admin on Fri Dec 15 14:57:59 GMT 2023 , Edited by admin on Fri Dec 15 14:57:59 GMT 2023
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m825
Created by
admin on Fri Dec 15 14:57:59 GMT 2023 , Edited by admin on Fri Dec 15 14:57:59 GMT 2023
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PRIMARY | Merck Index | ||
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169469
Created by
admin on Fri Dec 15 14:57:59 GMT 2023 , Edited by admin on Fri Dec 15 14:57:59 GMT 2023
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C81098
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admin on Fri Dec 15 14:57:59 GMT 2023 , Edited by admin on Fri Dec 15 14:57:59 GMT 2023
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SUB03224MIG
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admin on Fri Dec 15 14:57:59 GMT 2023 , Edited by admin on Fri Dec 15 14:57:59 GMT 2023
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6433365
Created by
admin on Fri Dec 15 14:57:59 GMT 2023 , Edited by admin on Fri Dec 15 14:57:59 GMT 2023
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222-277-9
Created by
admin on Fri Dec 15 14:57:59 GMT 2023 , Edited by admin on Fri Dec 15 14:57:59 GMT 2023
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100000085953
Created by
admin on Fri Dec 15 14:57:59 GMT 2023 , Edited by admin on Fri Dec 15 14:57:59 GMT 2023
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CHEMBL2110655
Created by
admin on Fri Dec 15 14:57:59 GMT 2023 , Edited by admin on Fri Dec 15 14:57:59 GMT 2023
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3403-42-7
Created by
admin on Fri Dec 15 14:57:59 GMT 2023 , Edited by admin on Fri Dec 15 14:57:59 GMT 2023
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PRIMARY |
Related Record | Type | Details | ||
---|---|---|---|---|
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE |