| SpectraBase Spectrum ID |
3MyvD6v4mPs |
| Name |
Benzoic acid, 3-[[[(5Z)-5-[(3-bromophenyl)methylene]-4-oxo-2-thioxothiazolidinyl]acetyl]amino]- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
475.950012251 u |
| Formula |
C19H13BrN2O4S2 |
| InChI |
InChI=1S/C19H13BrN2O4S2/c20-13-5-1-3-11(7-13)8-15-17(24)22(19(27)28-15)10-16(23)21-14-6-2-4-12(9-14)18(25)26/h1-9H,10H2,(H,21,23)(H,25,26)/b15-8- |
| InChIKey |
JTJWJGKEHYEFOA-NVNXTCNLSA-N |
| Molecular Weight |
477.347 g/mol |
| SMILES |
N(C(CN1C(S\C(C1=O)=C\C1=CC(Br)=CC=C1)=S)=O)C=1C=C(C(=O)O)C=CC1 |
![benzoic acid, 3-[[[(5Z)-5-[(3-bromophenyl)methylene]-4-oxo-2-thioxothiazolidinyl]acetyl]amino]-](/api/spectrum/3MyvD6v4mPs/structure.png?h=300&w=458 "benzoic acid, 3-[[[(5Z)-5-[(3-bromophenyl)methylene]-4-oxo-2-thioxothiazolidinyl]acetyl]amino]-")
