| SpectraBase Spectrum ID |
9AQda04lhax |
| Name |
2-(p-Cyanophenyl)-4-phenyl-2,3-dihydrobenzo[6,7-a]-(1,5)-thiazepine |
| Alternate Name(s) |
7-Phenyl-5-(p-cyanophenyl)-1-aza-4-thia-benzo[2,3-a]cycloheptane
4-(4-phenyl-2,3-dihydro-1,5-benzothiazepin-2-yl)benzenecarbonitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H16N2S |
| InChI |
InChI=1S/C22H16N2S/c23-15-16-10-12-18(13-11-16)22-14-20(17-6-2-1-3-7-17)24-19-8-4-5-9-21(19)25-22/h1-13,22H,14H2 |
| InChIKey |
YGJQZBMZJGUPJU-UHFFFAOYSA-N |
| Molecular Weight |
340.444 g/mol |
| SMILES |
C1(=Nc2c(SC(C1)c1ccc(C#N)cc1)cccc2)c1ccccc1 |
| SPLASH |
splash10-03di-0090000000-7e5919fc688a58e2d0b0 |
| Source of Spectrum |
OL-2-4184-7 |
| Wiley ID |
1547504 |
![2-(p-Cyanophenyl)-4-phenyl-2,3-dihydrobenzo[6,7-a]-(1,5)-thiazepine](/api/spectrum/9AQda04lhax/structure.png?h=300&w=458 "2-(p-Cyanophenyl)-4-phenyl-2,3-dihydrobenzo[6,7-a]-(1,5)-thiazepine")
