2-[2-(4-chlorophenyl)-2,3,4,5-tetrahydro-1,5-benzothiazepin-4-yl]phenol

SpectraBase Compound ID	CL1AA7nXfK0
InChI	InChI=1S/C21H18ClNOS/c22-15-11-9-14(10-12-15)21-13-18(16-5-1-3-7-19(16)24)23-17-6-2-4-8-20(17)25-21/h1-12,18,21,23-24H,13H2
InChIKey	ZSZZTHHVSXVNEW-UHFFFAOYSA-N Google Search
Mol Weight	367.89 g/mol
Molecular Formula	C21H18ClNOS
Exact Mass	367.079763 g/mol

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SpectraBase Spectrum ID	BvYd6a8cF4T
Name	2-[2-(4-chlorophenyl)-2,3,4,5-tetrahydro-1,5-benzothiazepin-4-yl]phenol
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H18ClNOS
InChI	InChI=1S/C21H18ClNOS/c22-15-11-9-14(10-12-15)21-13-18(16-5-1-3-7-19(16)24)23-17-6-2-4-8-20(17)25-21/h1-12,18,21,23-24H,13H2
InChIKey	ZSZZTHHVSXVNEW-UHFFFAOYSA-N
Literature Reference DOI	10.1002/rcm.1905
Molecular Weight	367.894 g/mol
SMILES	N1C(c2ccccc2O)CC(Sc2c1cccc2)c1ccc(cc1)Cl
SPLASH	splash10-000i-0943000000-d98ac236bfc55c52ce87
Source of Spectrum	RCM-19-1204-18
Synonyms	2-(2-(4-chlorophenyl)-2,3,4,5-tetrahydrobenzo[b][1,4]thiazepin-4-yl)phenol
Wiley ID	1820288