| SpectraBase Spectrum ID |
45kCh9k9tCk |
| Name |
7-Chloro-3-cyano-2,3-dihydro-2-phenyl-1,5-benzothiazepin-4(5H)-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H11ClN2OS |
| InChI |
InChI=1S/C16H11ClN2OS/c17-11-6-7-14-13(8-11)19-16(20)12(9-18)15(21-14)10-4-2-1-3-5-10/h1-8,12,15H,(H,19,20)/t12-,15+/m1/s1 |
| InChIKey |
VJOGHYOJGKWFLQ-DOMZBBRYSA-N |
| Molecular Weight |
314.790 g/mol |
| SMILES |
N1c2cc(ccc2S[C@]([C@](C1=O)(C#N)[H])(c1ccccc1)[H])Cl |
| SPLASH |
splash10-0udi-1393000000-70328ace18b3d6ec971c |
| Source of Spectrum |
SK-32-1088-3 |
| Synonyms |
(2R,3S)-7-Chloro-3-cyano-2,3-dihydro-2-phenyl-1,5-benzothiazepin-4(5H)-one
7-Chloro-4-oxo-2-phenyl-2,3,4,5-tetrahydro-1,5-benzothiazepine-3-carbonitrile
(2R,3S)-7-chloro-4-oxo-2-phenyl-3,5-dihydro-2H-1,5-benzothiazepine-3-carbonitrile
(2R,3S)-7-chloranyl-4-oxidanylidene-2-phenyl-3,5-dihydro-2H-1,5-benzothiazepine-3-carbonitrile |
| Wiley ID |
1548651 |
