| SpectraBase Spectrum ID |
2sgq7C5uTZv |
| Name |
5-Benzoyl-4-(3-methylbenzofuran-2-yl)-2-(phenylamino)thiophene-3-carbonitrile |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
434.108899000 u |
| Formula |
C27H18N2O2S |
| InChI |
InChI=1S/C27H18N2O2S/c1-17-20-14-8-9-15-22(20)31-25(17)23-21(16-28)27(29-19-12-6-3-7-13-19)32-26(23)24(30)18-10-4-2-5-11-18/h2-15,29H,1H3 |
| InChIKey |
WCQCNESXUTWXRO-UHFFFAOYSA-N |
| Molecular Weight |
434.513 g/mol |
| SMILES |
C=1C=C2C(=C(OC2=CC1)C=1C(C#N)=C(NC2=CC=CC=C2)SC1C(C1=CC=CC=C1)=O)C |
