| SpectraBase Spectrum ID |
5nMTzeWkG8M |
| Name |
4-{[(E)-(4-tert-butylphenyl)methylidene]amino}-5-(2-chlorophenyl)-4H-1,2,4-triazole-3-thiol |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
370.101895502 u |
| Formula |
C19H19ClN4S |
| InChI |
InChI=1S/C19H19ClN4S/c1-19(2,3)14-10-8-13(9-11-14)12-21-24-17(22-23-18(24)25)15-6-4-5-7-16(15)20/h4-12H,1-3H3,(H,23,25)/b21-12+ |
| InChIKey |
FVPDDBPXFMPHFS-CIAFOILYSA-N |
| Molecular Weight |
370.902 g/mol |
| SMILES |
SC=1N(C(=NN1)C1=C(Cl)C=CC=C1)\N=C\C=1C=CC(C(C)(C)C)=CC1 |
![4-{[(E)-(4-tert-butylphenyl)methylidene]amino}-5-(2-chlorophenyl)-4H-1,2,4-triazole-3-thiol](/api/spectrum/5nMTzeWkG8M/structure.png?h=300&w=458 "4-{[(E)-(4-tert-butylphenyl)methylidene]amino}-5-(2-chlorophenyl)-4H-1,2,4-triazole-3-thiol")
