Details
| Stereochemistry | RACEMIC |
| Molecular Formula | C19H25N3S.C4H4O4 |
| Molecular Weight | 443.559 |
| Optical Activity | ( + / - ) |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 1 |
| Charge | 0 |
SHOW SMILES / InChI
SMILES
OC(=O)\C=C\C(O)=O.CN(C)CC(CN1C2=C(SC3=C1C=CC=C3)C=CC=C2)N(C)C
InChI
InChIKey=CRWKVVGZQIWPES-WLHGVMLRSA-N
InChI=1S/C19H25N3S.C4H4O4/c1-20(2)13-15(21(3)4)14-22-16-9-5-7-11-18(16)23-19-12-8-6-10-17(19)22;5-3(6)1-2-4(7)8/h5-12,15H,13-14H2,1-4H3;1-2H,(H,5,6)(H,7,8)/b;2-1+
| Molecular Formula | C19H25N3S |
| Molecular Weight | 327.487 |
| Charge | 0 |
| Count |
|
| Stereochemistry | RACEMIC |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 1 |
| E/Z Centers | 0 |
| Optical Activity | ( + / - ) |
| 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 18:20:49 GMT 2025
by
admin
on
Mon Mar 31 18:20:49 GMT 2025
|
| Record UNII |
9KWA4W69IW
|
| Record Status |
Validated (UNII)
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| Record Version |
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-
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6433382
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169468
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18651-99-5
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C82295
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9KWA4W69IW
Created by
admin on Mon Mar 31 18:20:49 GMT 2025 , Edited by admin on Mon Mar 31 18:20:49 GMT 2025
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9KWA4W69IW
Created by
admin on Mon Mar 31 18:20:49 GMT 2025 , Edited by admin on Mon Mar 31 18:20:49 GMT 2025
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1440268
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2278-27-5
Created by
admin on Mon Mar 31 18:20:49 GMT 2025 , Edited by admin on Mon Mar 31 18:20:49 GMT 2025
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NON-SPECIFIC STOICHIOMETRY |
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PARENT -> SALT/SOLVATE | |||
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PARENT -> SALT/SOLVATE |