(1R*,7R*,8S*,11R*)-8-(4-Chlorophenyl)-11-phenyl-9-oxa-2,10-dithia-5-azatricyclo[5.2.2.0(1,5)]undecan-6-one

SpectraBase Compound ID	J6y1JcF5zoV
InChI	InChI=1S/C19H16ClNO2S2/c20-14-8-6-12(7-9-14)16-15-17(13-4-2-1-3-5-13)25-19(23-16)21(18(15)22)10-11-24-19/h1-9,15-17H,10-11H2/t15-,16+,17-,19+/m0/s1
InChIKey	AHVLMSHNDPNXIK-MJQMVNBJSA-N Google Search
Mol Weight	389.92 g/mol
Molecular Formula	C19H16ClNO2S2
Exact Mass	389.031099 g/mol

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SpectraBase Spectrum ID	1v4BkJoJ6vM
Name	(1R,7R,8S,11R)-8-(4-Chlorophenyl)-11-phenyl-9-oxa-2,10-dithia-5-azatricyclo[5.2.2.0(1,5)]undecan-6-one
Comments	Less than 3 mono-isotopic peaks
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C19H16ClNO2S2
InChI	InChI=1S/C19H16ClNO2S2/c20-14-8-6-12(7-9-14)16-15-17(13-4-2-1-3-5-13)25-19(23-16)21(18(15)22)10-11-24-19/h1-9,15-17H,10-11H2/t15-,16+,17-,19+/m0/s1
InChIKey	AHVLMSHNDPNXIK-MJQMVNBJSA-N
Molecular Weight	389.915 g/mol
SMILES	[C@]123N(C(=O)[C@]([C@](O3)(c3ccc(cc3)Cl)[H])([H])[C@@](S2)(c2ccccc2)[H])CCS1
SPLASH	splash10-014i-0903000000-75588d05c95e8473f37c
Source of Spectrum	QE-12-3900-4
Synonyms	(1R,7R,8S,11R)-8-(4-chlorophenyl)-11-phenyl-9-oxa-2,10-dithia-5-azatricyclo[5.2.2.0(1,5)]undecan-6-one
Wiley ID	1586922