| SpectraBase Spectrum ID |
LPkegt90tUs |
| Name |
1-Benzothiophene-2-carboxamide, N-[2-(1,3-benzothiazol-2-yl)phenyl]-3-chloro- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
420.015783094 u |
| Formula |
C22H13ClN2OS2 |
| InChI |
InChI=1S/C22H13ClN2OS2/c23-19-14-8-2-5-11-17(14)27-20(19)21(26)24-15-9-3-1-7-13(15)22-25-16-10-4-6-12-18(16)28-22/h1-12H,(H,24,26) |
| InChIKey |
DNRKRPKFXQMCFI-UHFFFAOYSA-N |
| Molecular Weight |
420.932 g/mol |
| SMILES |
C1=CC2=C(N=C(C=3C(=CC=CC3)NC(=O)C=3SC4=C(C3Cl)C=CC=C4)S2)C=C1 |
![1-Benzothiophene-2-carboxamide, N-[2-(1,3-benzothiazol-2-yl)phenyl]-3-chloro-](/api/spectrum/LPkegt90tUs/structure.png?h=300&w=458 "1-Benzothiophene-2-carboxamide, N-[2-(1,3-benzothiazol-2-yl)phenyl]-3-chloro-")
