| SpectraBase Spectrum ID |
CJkfKLCbhYK |
| Name |
3-{[3''-(N-Phenyl-N-mercaptoethylamino)-5''-(p-methylphenyl)]isoxazol-4'-yl}-1,2,4-triazole |
| Alternate Name(s) |
2-{[5-(4-methylphenyl)-4-(1H-1,2,4-triazol-3-yl)-3-isoxazolyl]anilino}ethanethiol
2-{[5-(4-methylphenyl)-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 |
C20H19N5OS |
| InChI |
InChI=1S/C20H19N5OS/c1-14-7-9-15(10-8-14)18-17(19-21-13-22-23-19)20(24-26-18)25(11-12-27)16-5-3-2-4-6-16/h2-10,13,27H,11-12H2,1H3,(H,21,22,23) |
| InChIKey |
NZNRHGSXEFYNII-UHFFFAOYSA-N |
| Molecular Weight |
377.466 g/mol |
| SMILES |
SCCN(c1c(-c2n[nH]cn2)c(on1)-c1ccc(cc1)C)c1ccccc1 |
| SPLASH |
splash10-014l-7900000000-fe7f72f2346b7f2c1f61 |
| Source of Spectrum |
SK-23-3222-3 |
| Wiley ID |
865846 |
![3-{[3''-(N-Phenyl-N-mercaptoethylamino)-5''-(p-methylphenyl)]isoxazol-4'-yl}-1,2,4-triazole](/api/spectrum/CJkfKLCbhYK/structure.png?h=300&w=458 "3-{[3''-(N-Phenyl-N-mercaptoethylamino)-5''-(p-methylphenyl)]isoxazol-4'-yl}-1,2,4-triazole")
