| SpectraBase Spectrum ID |
FzaaAAoHibP |
| Name |
Benzoic acid, 4-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-, methyl ester |
| Alternate Name(s) |
4-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]benzoic acid methyl ester
Methyl 4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanylmethyl]benzoate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H12N2O2S2 |
| InChI |
InChI=1S/C12H12N2O2S2/c1-8-13-14-12(18-8)17-7-9-3-5-10(6-4-9)11(15)16-2/h3-6H,7H2,1-2H3 |
| InChIKey |
IJCRIPJXXKVIQV-UHFFFAOYSA-N |
| Molecular Weight |
280.360 g/mol |
| SMILES |
COC(c1ccc(CSc2sc(nn2)C)cc1)=O |
| SPLASH |
splash10-059w-6960000000-027ea415caa03f7aaa3a |
| Wiley ID |
1447063 |
![Benzoic acid, 4-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-, methyl ester](/api/spectrum/FzaaAAoHibP/structure.png?h=300&w=458 "Benzoic acid, 4-[[(5-methyl-1,3,4-thiadiazol-2-yl)thio]methyl]-, methyl ester")
