SpectraBase Spectrum ID |
KSfCQzPHukU |
Name |
1-Ethanone, 1-[4-(1H-1,3-benzimidazol-2-ylthio)-3-nitrophenyl]- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
313.052112397 u |
Formula |
C15H11N3O3S |
InChI |
InChI=1S/C15H11N3O3S/c1-9(19)10-6-7-14(13(8-10)18(20)21)22-15-16-11-4-2-3-5-12(11)17-15/h2-8H,1H3,(H,16,17) |
InChIKey |
SLPIJEOCCRQURC-UHFFFAOYSA-N |
Molecular Weight |
313.331 g/mol |
SMILES |
CC(=O)C1=CC=C(C(=C1)N(=O)=O)SC1=NC=2C=CC=CC2N1 |