| SpectraBase Spectrum ID |
5bz1BX3lgBy |
| Name |
4,5-dihydro-3-(10H-phenothiazin-2-yl)-5-(1,3-diphenyl-1H-pyrazol-4-yl)pyrazole-1-carbothioamide |
| Appearance |
Dark yellow crystals |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C31H24N6S2 |
| InChI |
InChI=1S/C31H24N6S2/c32-31(38)37-27(23-19-36(22-11-5-2-6-12-22)35-30(23)20-9-3-1-4-10-20)18-25(34-37)21-15-16-29-26(17-21)33-24-13-7-8-14-28(24)39-29/h1-17,19,27,33H,18H2,(H2,32,38) |
| InChIKey |
MPRQNJLDEUESQL-UHFFFAOYSA-N |
| Instrument Name |
Kratos MS equipment or Varian MAT 311A |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/jhet.2716 |
| Molecular Weight |
544.695 g/mol |
| SMILES |
N1c2c(Sc3c1cc(C1=NN(C(=S)N)C(C1)c1c(n[n](c1)-c1ccccc1)-c1ccccc1)cc3)cccc2 |
| SPLASH |
splash10-000b-7940000000-427ece15439749069eff |
| Source of Spectrum |
Y-54-1375-29 |
| Thin-Layer Chromatography |
Rf = 0.28 (pet. ether (40-60)/ethyl acetate, 4:1) |
| Wiley ID |
1878179 |
