| SpectraBase Spectrum ID |
4zfIVTPPbt7 |
| Name |
8-[(Carboxamidinylthio)methyl]-6-methyl-2-(4'-chlorophenyl)-4H-[1]-benzopyran-4-one |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H16BrClN2O2S |
| InChI |
InChI=1S/C18H15ClN2O2S.BrH/c1-10-6-12(9-24-18(20)21)17-14(7-10)15(22)8-16(23-17)11-2-4-13(19)5-3-11;/h2-8H,9H2,1H3,(H3,20,21);1H |
| InChIKey |
WIEMXTUZICPGEK-UHFFFAOYSA-N |
| Molecular Weight |
439.755 g/mol |
| SMILES |
[Br-].[NH2+]=C(SCc1c2OC(c3ccc(Cl)cc3)=CC(c2cc(c1)C)=O)N |
| SPLASH |
splash10-0002-0940000000-8c2ad93dd0c6c4f9766c |
| Source of Spectrum |
D8-329-496-15 |
| Synonyms |
8-[(Aminocarbonyl-imidinyl)thiomethyl]-6-methyl-2-(4'-chlorophenyl)-4H-[1]-benzopyran-4-one |
| Wiley ID |
1516343 |
![8-[(Carboxamidinylthio)methyl]-6-methyl-2-(4'-chlorophenyl)-4H-[1]-benzopyran-4-one](/api/spectrum/4zfIVTPPbt7/structure.png?h=300&w=458 "8-[(Carboxamidinylthio)methyl]-6-methyl-2-(4'-chlorophenyl)-4H-[1]-benzopyran-4-one")
