| SpectraBase Spectrum ID |
c5kYdObGaM |
| Name |
2-[1-(4-Chlorophenyl)tetrazol-5-yl]sulfanyl-1-[2-(trifluoromethyl)phenothiazin-10-yl]ethanone |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
519.020214595 u |
| Formula |
C22H13ClF3N5OS2 |
| InChI |
InChI=1S/C22H13ClF3N5OS2/c23-14-6-8-15(9-7-14)31-21(27-28-29-31)33-12-20(32)30-16-3-1-2-4-18(16)34-19-10-5-13(11-17(19)30)22(24,25)26/h1-11H,12H2 |
| InChIKey |
DVPCTMRNRHAFBW-UHFFFAOYSA-N |
| Molecular Weight |
519.948 g/mol |
| SMILES |
C=1C=CC=2N(C(CSC=3N(N=NN3)C3=CC=C(C=C3)Cl)=O)C3=C(C=CC(C(F)(F)F)=C3)SC2C1 |
![2-[1-(4-Chlorophenyl)tetrazol-5-yl]sulfanyl-1-[2-(trifluoromethyl)phenothiazin-10-yl]ethanone](/api/spectrum/c5kYdObGaM/structure.png?h=300&w=458 "2-[1-(4-Chlorophenyl)tetrazol-5-yl]sulfanyl-1-[2-(trifluoromethyl)phenothiazin-10-yl]ethanone")
