| SpectraBase Spectrum ID |
3KwDbaqjRCT |
| Name |
3-Cyano-2,3-dihydro-2-(p-bromophenyl)-1,5-benzothiazepin-4(5H)-one |
| Alternate Name(s) |
(2R,3S)-2-(4-Bromo-phenyl)-4-oxo-2,3,4,5-tetrahydro-benzo[b][1,4]thiazepine-3-carbonitrile
2-(4-bromophenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepine-3-carbonitrile
3-Cyano-2,3-dihydro-2-(4'-bromophenyl)-1,5-benzothiazepin-4(5H)-one
3-Cyano-2,3-dihydro-2-(p-bromoophenyl)-1,5-benzothiazepin-4(5H)-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H11BrN2OS |
| InChI |
InChI=1S/C16H11BrN2OS/c17-11-7-5-10(6-8-11)15-12(9-18)16(20)19-13-3-1-2-4-14(13)21-15/h1-8,12,15H,(H,19,20)/t12-,15+/m1/s1 |
| InChIKey |
QSBLDKHWVLBGJX-DOMZBBRYSA-N |
| Molecular Weight |
359.241 g/mol |
| SMILES |
N1c2ccccc2S[C@]([C@](C1=O)(C#N)[H])(c1ccc(cc1)Br)[H] |
| SPLASH |
splash10-0bt9-1094000000-f22c24600b5bebdb2a14 |
| Source of Spectrum |
SK-32-1089-3 |
| Wiley ID |
882466 |
