| SpectraBase Spectrum ID |
BSpgQ7mBRyA |
| Name |
3-(2-Hydroxypropyl)-5-benzoylmethylsulfanyl-2,3-dihydro-1,3,4-thiadiazole-2-thione |
| Alternate Name(s) |
2-{[4-(2-hydroxypropyl)-5-thioxo-4,5-dihydro-1,3,4-thiadiazol-2-yl]sulfanyl}-1-phenylethanone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H14N2O2S3 |
| InChI |
InChI=1S/C13H14N2O2S3/c1-9(16)7-15-13(18)20-12(14-15)19-8-11(17)10-5-3-2-4-6-10/h2-6,9,16H,7-8H2,1H3 |
| InChIKey |
DCJFXZKXNDTSQX-UHFFFAOYSA-N |
| Molecular Weight |
326.447 g/mol |
| SMILES |
OC(CN1C(SC(=N1)SCC(c1ccccc1)=O)=S)C |
| SPLASH |
splash10-0aor-0952000000-d6595ff4858277ef821f |
| Source of Spectrum |
CV-2004-1261-9 |
| Wiley ID |
1611446 |
