SpectraBase Spectrum ID |
DtfmoJTu1LM |
Name |
Thioacetic acid, S-[1-acetyl-3-(4-chlorophenyl)-5-methylthio-4-pyrazolyl] ester |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C14H13ClN2O2S2 |
InChI |
InChI=1S/C14H13ClN2O2S2/c1-8(18)17-14(20-3)13(21-9(2)19)12(16-17)10-4-6-11(15)7-5-10/h4-7H,1-3H3 |
InChIKey |
JVDZFEYVXXGIKV-UHFFFAOYSA-N |
Molecular Weight |
340.843 g/mol |
SMILES |
c1(c([n](C(=O)C)nc1-c1ccc(Cl)cc1)SC)SC(=O)C |
SPLASH |
splash10-052f-9560000000-13cada53483e29347b64 |
Source of Spectrum |
AD-0-2532-0 |
Synonyms |
Ethanethioic acid S-[1-acetyl-3-(4-chlorophenyl)-5-(methylthio)-4-pyrazolyl] ester
S-[1-acetyl-3-(4-chlorophenyl)-5-methylsulfanylpyrazol-4-yl] ethanethioate
S-[1-acetyl-3-(4-chlorophenyl)-5-methylsulfanyl-pyrazol-4-yl] ethanethioate
S-[3-(4-chlorophenyl)-1-ethanoyl-5-methylsulfanyl-pyrazol-4-yl] ethanethioate |
Wiley ID |
1427873 |