| SpectraBase Spectrum ID |
F1gIwSpl2Xn |
| Name |
3-{[3''-(N-Phenyl-N-mercaptoethylamino)-5''-(p-methoxyphenyl)]isoxazol-4'-yl}-1,2,4-triazole |
| Alternate Name(s) |
2-{[5-(4-methoxyphenyl)-4-(1H-1,2,4-triazol-3-yl)-3-isoxazolyl]anilino}ethanethiol
2-{[5-(4-methoxyphenyl)-4-(1H-1,2,4-triazol-3-yl)-3-isoxazolyl]anilino}ethyl hydrosulfide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H19N5O2S |
| InChI |
InChI=1S/C20H19N5O2S/c1-26-16-9-7-14(8-10-16)18-17(19-21-13-22-23-19)20(24-27-18)25(11-12-28)15-5-3-2-4-6-15/h2-10,13,28H,11-12H2,1H3,(H,21,22,23) |
| InChIKey |
JBECVUWDQHZIJF-UHFFFAOYSA-N |
| Molecular Weight |
393.465 g/mol |
| SMILES |
SCCN(c1c(-c2n[nH]cn2)c(on1)-c1ccc(cc1)OC)c1ccccc1 |
| SPLASH |
splash10-000i-4900000000-2df2373f0e83fc496f36 |
| Source of Spectrum |
SK-23-3222-3 |
| Wiley ID |
865847 |
![3-{[3''-(N-Phenyl-N-mercaptoethylamino)-5''-(p-methoxyphenyl)]isoxazol-4'-yl}-1,2,4-triazole](/api/spectrum/F1gIwSpl2Xn/structure.png?h=300&w=458 "3-{[3''-(N-Phenyl-N-mercaptoethylamino)-5''-(p-methoxyphenyl)]isoxazol-4'-yl}-1,2,4-triazole")
