| SpectraBase Spectrum ID |
70ml5z1dJp4 |
| Name |
7-(4-Chlorophenyl)-3,5-diphenyl-1-tosyl-2,3-dihydro-1H-azepine |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C31H26ClNO2S |
| InChI |
InChI=1S/C31H26ClNO2S/c1-23-12-18-30(19-13-23)36(34,35)33-22-28(25-10-6-3-7-11-25)20-27(24-8-4-2-5-9-24)21-31(33)26-14-16-29(32)17-15-26/h2-21,28H,22H2,1H3 |
| InChIKey |
PKPHUYXDPQCPIS-UHFFFAOYSA-N |
| Literature Reference DOI |
10.1002/anie.201304902 |
| Molecular Weight |
512.067 g/mol |
| SMILES |
C1N(C(=CC(c2ccccc2)=CC1c1ccccc1)c1ccc(cc1)Cl)S(c1ccc(cc1)C)(=O)=O |
| SPLASH |
splash10-0a4i-2209000000-1ae21496e3ef78ba9fc2 |
| Source of Spectrum |
ACI-52-SM-5 |
| Wiley ID |
1781810 |
