| SpectraBase Spectrum ID |
3ShSYpBOdFA |
| Name |
N-((Z)-1-{4-[(Z)-2-Hydroxy-1-hydroxymethyl-2-(4-methylsulfanyl-phenyl)-ethylimino]-4H-benzo[d][1,3]oxazin-2-yl}-2-thiophen-2-yl-vinyl)-benzamide |
| Alternate Name(s) |
2-[.alpha.-Benzoylamino-.beta.-2-thienylvinyl]-4-[N-[1,3-dihydroxy-1-(p-methylthiophenyl)prop-2-yl]imino]benzoxazine dev.
N-[(Z)-1-[(4Z)-4-({(Z)-2-hydroxy-1-(hydroxymethyl)-2-[4-(methylsulfanyl)phenyl]ethyl}imino)-4H-3,1-benzoxazin-2-yl]-2-(2-thienyl)ethenyl]benzamide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C31H27N3O4S2 |
| InChI |
InChI=1S/C31H27N3O4S2/c1-39-22-15-13-20(14-16-22)28(36)27(19-35)34-30-24-11-5-6-12-25(24)33-31(38-30)26(18-23-10-7-17-40-23)32-29(37)21-8-3-2-4-9-21/h2-18,27-28,35-36H,19H2,1H3,(H,32,37)/b26-18-,34-30- |
| InChIKey |
OIEJQMNKLUQFRS-YZAQJVMESA-N |
| Molecular Weight |
569.694 g/mol |
| SMILES |
N(\C(C=1O\C(=N/C(CO)C(c2ccc(cc2)SC)O)c2c(N1)cccc2)=C/c1sccc1)C(=O)c1ccccc1 |
| SPLASH |
splash10-0a4i-0900010000-f2f24de57b4709f5172b |
| Source of Spectrum |
Y1-39-268-13 |
| Wiley ID |
1528031 |
![N-((Z)-1-{4-[(Z)-2-Hydroxy-1-hydroxymethyl-2-(4-methylsulfanyl-phenyl)-ethylimino]-4H-benzo[d][1,3]oxazin-2-yl}-2-thiophen-2-yl-vinyl)-benzamide](/api/spectrum/3ShSYpBOdFA/structure.png?h=300&w=458 "N-((Z)-1-{4-[(Z)-2-Hydroxy-1-hydroxymethyl-2-(4-methylsulfanyl-phenyl)-ethylimino]-4H-benzo[d][1,3]oxazin-2-yl}-2-thiophen-2-yl-vinyl)-benzamide")
