Acetic acid, 2-[[4-methyl-5-[[9-oxo-10(9H)-acridinyl]methyl]-4H-1,2,4-triazol-3-yl]thio]-, ethyl ester

SpectraBase Compound ID	A7PEtEhsTWa
InChI	InChI=1S/C21H20N4O3S/c1-3-28-19(26)13-29-21-23-22-18(24(21)2)12-25-16-10-6-4-8-14(16)20(27)15-9-5-7-11-17(15)25/h4-11H,3,12-13H2,1-2H3
InChIKey	REUDDUZJERGIDN-UHFFFAOYSA-N Google Search
Mol Weight	408.48 g/mol
Molecular Formula	C21H20N4O3S
Exact Mass	408.125612 g/mol

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SpectraBase Spectrum ID	EHz7FOZ1qDR
Name	Acetic acid, 2-[[4-methyl-5-[[9-oxo-10(9H)-acridinyl]methyl]-4H-1,2,4-triazol-3-yl]thio]-, ethyl ester
Alternate Name(s)	2-[[4-methyl-5-[(9-oxo-10-acridinyl)methyl]-1,2,4-triazol-3-yl]thio]acetic acid ethyl ester Ethyl 2-[[4-methyl-5-[(9-oxoacridin-10-yl)methyl]-1,2,4-triazol-3-yl]sulfanyl]acetate Ethyl 2-[[4-methyl-5-[(9-oxidanylideneacridin-10-yl)methyl]-1,2,4-triazol-3-yl]sulfanyl]ethanoate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H20N4O3S
InChI	InChI=1S/C21H20N4O3S/c1-3-28-19(26)13-29-21-23-22-18(24(21)2)12-25-16-10-6-4-8-14(16)20(27)15-9-5-7-11-17(15)25/h4-11H,3,12-13H2,1-2H3
InChIKey	REUDDUZJERGIDN-UHFFFAOYSA-N
Molecular Weight	408.476 g/mol
SMILES	c1ccc2N(Cc3[n](c(nn3)SCC(OCC)=O)C)c3c(C(=O)c2c1)cccc3
SPLASH	splash10-03di-9870000000-85c7f2d4264000fa75a3
Source of Spectrum	IY-1-4531-2
Wiley ID	1653295