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=CC=C2SC3=C(C=CC=C3)N(CCCN(C)C)C2=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 | C18H22N2OS |
| Molecular Weight | 314.445 |
| 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
Mon Mar 31 17:33:12 GMT 2025
by
admin
on
Mon Mar 31 17:33:12 GMT 2025
|
| Record UNII |
OR0RPY2Y2V
|
| Record Status |
Validated (UNII)
|
| Record Version |
|
-
Download
| Name | Type | Language | ||
|---|---|---|---|---|
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Common Name | English | ||
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Preferred Name | English | ||
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Common Name | English | ||
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Common Name | English | ||
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Code | English |
| Classification Tree | Code System | Code | ||
|---|---|---|---|---|
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NCI_THESAURUS |
C66883
Created by
admin on Mon Mar 31 17:33:12 GMT 2025 , Edited by admin on Mon Mar 31 17:33:12 GMT 2025
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NCI_THESAURUS |
C66885
Created by
admin on Mon Mar 31 17:33:12 GMT 2025 , Edited by admin on Mon Mar 31 17:33:12 GMT 2025
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| Code System | Code | Type | Description | ||
|---|---|---|---|---|---|
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OR0RPY2Y2V
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m825
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admin on Mon Mar 31 17:33:12 GMT 2025 , Edited by admin on Mon Mar 31 17:33:12 GMT 2025
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PRIMARY | Merck Index | ||
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169469
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C81098
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SUB03224MIG
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6433365
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222-277-9
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100000085953
Created by
admin on Mon Mar 31 17:33:12 GMT 2025 , Edited by admin on Mon Mar 31 17:33:12 GMT 2025
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CHEMBL2110655
Created by
admin on Mon Mar 31 17:33:12 GMT 2025 , Edited by admin on Mon Mar 31 17:33:12 GMT 2025
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3403-42-7
Created by
admin on Mon Mar 31 17:33:12 GMT 2025 , Edited by admin on Mon Mar 31 17:33:12 GMT 2025
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PRIMARY |
| Related Record | Type | Details | ||
|---|---|---|---|---|
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PARENT -> SALT/SOLVATE | |||
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