| SpectraBase Spectrum ID |
CqupgL7xWwi |
| Name |
3-{[3''-(N-Phenyl-N-mercaptopropylamino)-5''-(p-methylphenyl)]isoxazol-4'-yl}-1,2,4-triazole |
| Alternate Name(s) |
3-{[5-(4-methylphenyl)-4-(1H-1,2,4-triazol-3-yl)-3-isoxazolyl]anilino}-1-propanethiol
3-{[5-(4-methylphenyl)-4-(1H-1,2,4-triazol-3-yl)-3-isoxazolyl]anilino}propyl hydrosulfide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H21N5OS |
| InChI |
InChI=1S/C21H21N5OS/c1-15-8-10-16(11-9-15)19-18(20-22-14-23-24-20)21(25-27-19)26(12-5-13-28)17-6-3-2-4-7-17/h2-4,6-11,14,28H,5,12-13H2,1H3,(H,22,23,24) |
| InChIKey |
NHWURQCBXIVTNM-UHFFFAOYSA-N |
| Molecular Weight |
391.493 g/mol |
| SMILES |
SCCCN(c1c(-c2n[nH]cn2)c(on1)-c1ccc(cc1)C)c1ccccc1 |
| SPLASH |
splash10-014l-9712000000-07c6cb0e467e2cfaf9f2 |
| Source of Spectrum |
SK-23-3224-3 |
| Wiley ID |
865842 |
![3-{[3''-(N-Phenyl-N-mercaptopropylamino)-5''-(p-methylphenyl)]isoxazol-4'-yl}-1,2,4-triazole](/api/spectrum/CqupgL7xWwi/structure.png?h=300&w=458 "3-{[3''-(N-Phenyl-N-mercaptopropylamino)-5''-(p-methylphenyl)]isoxazol-4'-yl}-1,2,4-triazole")
