5-[2'-bis(Ethoxyphosphonato)-1'-(p-dimethylaminophenyl)ethyl]-4-oxo-(1,3)-(tetrahydro)thiazole-2-thione

SpectraBase Compound ID	IMWEt4X1M2X
InChI	InChI=1S/C21H34N2O7P2S2/c1-7-27-31(25,28-8-2)20(32(26,29-9-3)30-10-4)17(18-19(24)22-21(33)34-18)15-11-13-16(14-12-15)23(5)6/h11-14,17-18,20H,7-10H2,1-6H3,(H,22,24,33)
InChIKey	JAHIRZKLXTWEBX-UHFFFAOYSA-N Google Search
Mol Weight	552.6 g/mol
Molecular Formula	C21H34N2O7P2S2
Exact Mass	552.128268 g/mol

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SpectraBase Spectrum ID	8Pg39X8J2dh
Name	5-[2'-bis(Ethoxyphosphonato)-1'-(p-dimethylaminophenyl)ethyl]-4-oxo-(1,3)-(tetrahydro)thiazole-2-thione
Alternate Name(s)	5-[2,2-bis(diethoxyphosphoryl)-1-[4-(dimethylamino)phenyl]ethyl]-2-sulfanylidene-4-thiazolidinone 5-[2,2-bis(diethoxyphosphoryl)-1-[4-(dimethylamino)phenyl]ethyl]-2-sulfanylidene-1,3-thiazolidin-4-one
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H34N2O7P2S2
InChI	InChI=1S/C21H34N2O7P2S2/c1-7-27-31(25,28-8-2)20(32(26,29-9-3)30-10-4)17(18-19(24)22-21(33)34-18)15-11-13-16(14-12-15)23(5)6/h11-14,17-18,20H,7-10H2,1-6H3,(H,22,24,33)
InChIKey	JAHIRZKLXTWEBX-UHFFFAOYSA-N
Molecular Weight	552.578 g/mol
SMILES	N1C(SC(C1=O)C(C(P(=O)(OCC)OCC)P(=O)(OCC)OCC)c1ccc(cc1)N(C)C)=S
SPLASH	splash10-0002-0049430000-45d9c1cf2c8a340ef481
Source of Spectrum	D1-2003-786-3
Wiley ID	1548378