| SpectraBase Spectrum ID |
FIxaGt5MoUQ |
| Name |
7-Chloro-3-cyano-2,3-dihydro-2-(p-tolyl)-1,5-benzothiazepin-4(5H)-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H13ClN2OS |
| InChI |
InChI=1S/C17H13ClN2OS/c1-10-2-4-11(5-3-10)16-13(9-19)17(21)20-14-8-12(18)6-7-15(14)22-16/h2-8,13,16H,1H3,(H,20,21)/t13-,16+/m1/s1 |
| InChIKey |
ZICABOMPSQXYLP-CJNGLKHVSA-N |
| Molecular Weight |
328.817 g/mol |
| SMILES |
N1c2cc(ccc2S[C@]([C@](C1=O)(C#N)[H])(c1ccc(cc1)C)[H])Cl |
| SPLASH |
splash10-0bt9-1950000000-756ccd2b1ddab7566713 |
| Source of Spectrum |
SK-32-1088-3 |
| Synonyms |
(2R,3S)-7-Chloro-4-oxo-2-p-tolyl-2,3,4,5-tetrahydro-benzo[b][1,4]thiazepine-3-carbonitrile
7-Chloro-2-(4-methylphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-3-carbonitrile
7-Chloro-3-cyano-2,3-dihydro-2-(4'-methylphenyl)-1,5-benzothiazepin-4(5H)-one
(2R,3S)-7-chloro-2-(4-methylphenyl)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-3-carbonitrile
(2R,3S)-7-chloro-4-oxo-2-(p-tolyl)-3,5-dihydro-2H-1,5-benzothiazepine-3-carbonitrile
(2R,3S)-7-chloranyl-2-(4-methylphenyl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-3-carbonitrile |
| Wiley ID |
882473 |
