| SpectraBase Spectrum ID |
4hB6w2vx1u6 |
| Name |
4-((4-(((1H-benzo[D]imidazol-2-yl)thio)methyl)-1H-1,2,3-triazol-1-yl)methyl)-7-hydroxy-2H-chromen-2-one |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
405.089560534 u |
| Formula |
C20H15N5O3S |
| InChI |
InChI=1S/C20H15N5O3S/c26-14-5-6-15-12(7-19(27)28-18(15)8-14)9-25-10-13(23-24-25)11-29-20-21-16-3-1-2-4-17(16)22-20/h1-8,10,26H,9,11H2,(H,21,22) |
| InChIKey |
FWUHFIXMVNNUOV-UHFFFAOYSA-N |
| Molecular Weight |
405.432 g/mol |
| SMILES |
C1=C(C=C2C(=C1)C(=CC(O2)=O)CN1N=NC(=C1)CSC1=NC2=C(N1)C=CC=C2)O |
![4-((4-(((1H-benzo[d]imidazol-2-yl)thio)methyl)-1H-1,2,3-triazol-1-yl)methyl)-7-hydroxy-2H-chromen-2-one](/api/spectrum/4hB6w2vx1u6/structure.png?h=300&w=458 "4-((4-(((1H-benzo[d]imidazol-2-yl)thio)methyl)-1H-1,2,3-triazol-1-yl)methyl)-7-hydroxy-2H-chromen-2-one")
