SpectraBase Spectrum ID |
CmMShErYauO |
Name |
Hydrazinecarbothioic acid, [(3-benzoyl-5-phenyl-4-isothiazolyl)phenylmethylene]-, O-methyl ester |
CAS Registry Number |
110315-37-2 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C25H19N3O2S2 |
InChI |
InChI=1S/C25H19N3O2S2/c1-30-25(31)27-26-21(17-11-5-2-6-12-17)20-22(23(29)18-13-7-3-8-14-18)28-32-24(20)19-15-9-4-10-16-19/h2-16H,1H3,(H,27,31)/b26-21+ |
InChIKey |
HWEDEJZNYOOLOZ-YYADALCUSA-N |
Molecular Weight |
457.566 g/mol |
SMILES |
N(C(=S)OC)\N=C\(c1c(nsc1-c1ccccc1)C(=O)c1ccccc1)c1ccccc1 |
SPLASH |
splash10-0kcr-9404100000-438c966d0e2995418b18 |
Source of Spectrum |
K-121-102-25 |
Synonyms |
O-methyl (2E)-2-[(3-benzoyl-5-phenyl-4-isothiazolyl)(phenyl)methylene]hydrazinecarbothioate |
Wiley ID |
1389629 |