Ethyl 4-methyl-2-{[phenyl(phenylsulfanyl)acetyl]amino}-1,3-thiazole-5-carboxylate

SpectraBase Compound ID	7c7APNEN6EB
InChI	InChI=1S/C21H20N2O3S2/c1-3-26-20(25)17-14(2)22-21(28-17)23-19(24)18(15-10-6-4-7-11-15)27-16-12-8-5-9-13-16/h4-13,18H,3H2,1-2H3,(H,22,23,24)
InChIKey	CFDWLJBDPSHDGN-UHFFFAOYSA-N Google Search
Mol Weight	412.52 g/mol
Molecular Formula	C21H20N2O3S2
Exact Mass	412.091535 g/mol

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SpectraBase Spectrum ID	82gYicZa1R3
Name	Ethyl 4-methyl-2-{[phenyl(phenylsulfanyl)acetyl]amino}-1,3-thiazole-5-carboxylate
Comments	Computed using HOSE algorithm
Copyright	Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass	412.091534857 u
Formula	C21H20N2O3S2
InChI	InChI=1S/C21H20N2O3S2/c1-3-26-20(25)17-14(2)22-21(28-17)23-19(24)18(15-10-6-4-7-11-15)27-16-12-8-5-9-13-16/h4-13,18H,3H2,1-2H3,(H,22,23,24)
InChIKey	CFDWLJBDPSHDGN-UHFFFAOYSA-N
Molecular Weight	412.522 g/mol
SMILES	N(C=1SC(=C(N1)C)C(=O)OCC)C(C(SC1=CC=CC=C1)C=1C=CC=CC1)=O