Butanedioic acid, [[2-phenyl-4-(phenylmethyl)-5-thiazolyl]thio]-, dimethyl ester

SpectraBase Compound ID	AZSvvjibPyh
InChI	InChI=1S/C22H21NO4S2/c1-26-19(24)14-18(21(25)27-2)28-22-17(13-15-9-5-3-6-10-15)23-20(29-22)16-11-7-4-8-12-16/h3-12,18H,13-14H2,1-2H3
InChIKey	BLRYVYWRONRDIK-UHFFFAOYSA-N Google Search
Mol Weight	427.53 g/mol
Molecular Formula	C22H21NO4S2
Exact Mass	427.091201 g/mol

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SpectraBase Spectrum ID	6UqWu4mQ0py
Name	Butanedioic acid, [[2-phenyl-4-(phenylmethyl)-5-thiazolyl]thio]-, dimethyl ester
Alternate Name(s)	Dimethyl 2-[(4-benzyl-2-phenyl-1,3-thiazol-5-yl)sulfanyl]succinate Dimethyl-2-(5-benzyl-2-phenyl thiazol-4-ylthio)-1,3-propandiol
CAS Registry Number	60026-84-8
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C22H21NO4S2
InChI	InChI=1S/C22H21NO4S2/c1-26-19(24)14-18(21(25)27-2)28-22-17(13-15-9-5-3-6-10-15)23-20(29-22)16-11-7-4-8-12-16/h3-12,18H,13-14H2,1-2H3
InChIKey	BLRYVYWRONRDIK-UHFFFAOYSA-N
Molecular Weight	427.533 g/mol
SMILES	c1(sc(-c2ccccc2)nc1Cc1ccccc1)SC(CC(=O)OC)C(=O)OC
SPLASH	splash10-0ugi-0590400000-dd83927fc7848dec3d89
Source of Spectrum	F-32-584-0
Wiley ID	1380368