| SpectraBase Spectrum ID |
GVYe2NtPlsD |
| Name |
4,5-Dihydro-4-phenyl-N,5,5-trimethyl-3-(methylthio)-1H-1,2,4-triazole-1-carboxamide |
| Alternate Name(s) |
N,5,5-trimethyl-3-(methylsulfanyl)-4-phenyl-4,5-dihydro-1H-1,2,4-triazole-1-carboxamide |
| CAS Registry Number |
89579-01-1 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H18N4OS |
| InChI |
InChI=1S/C13H18N4OS/c1-13(2)16(10-8-6-5-7-9-10)12(19-4)15-17(13)11(18)14-3/h5-9H,1-4H3,(H,14,18) |
| InChIKey |
WSTJWXWFTKIPGY-UHFFFAOYSA-N |
| Molecular Weight |
278.374 g/mol |
| SMILES |
N(C(N1C(N(c2ccccc2)C(=N1)SC)(C)C)=O)C |
| SPLASH |
splash10-0a4i-0090000000-f04a646c73c480e2e735 |
| Source of Spectrum |
J-49-1706-0 |
| Wiley ID |
1281666 |
