2,7-bis[N'-(Ethoxycarbonyl)thiourea]-9H-fluorene

SpectraBase Compound ID	5dQxO49uRkv
InChI	InChI=1S/C21H22N4O4S2/c1-3-28-20(26)24-18(30)22-14-5-7-16-12(10-14)9-13-11-15(6-8-17(13)16)23-19(31)25-21(27)29-4-2/h5-8,10-11H,3-4,9H2,1-2H3,(H2,22,24,26,30)(H2,23,25,27,31)
InChIKey	TYKQOVFHUYMSKF-UHFFFAOYSA-N Google Search
Mol Weight	458.55 g/mol
Molecular Formula	C21H22N4O4S2
Exact Mass	458.108248 g/mol

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SpectraBase Spectrum ID	BNJT9s6vhw4
Name	2,7-bis[N'-(Ethoxycarbonyl)thiourea]-9H-fluorene
Alternate Name(s)	N-[[[7-[[(ethoxycarbonylamino)-sulfanylidenemethyl]amino]-9H-fluoren-2-yl]amino]-sulfanylidenemethyl]carbamic acid ethyl ester Ethyl N-[[7-(ethoxycarbonylcarbamothioylamino)-9H-fluoren-2-yl]carbamothioyl]carbamate
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H22N4O4S2
InChI	InChI=1S/C21H22N4O4S2/c1-3-28-20(26)24-18(30)22-14-5-7-16-12(10-14)9-13-11-15(6-8-17(13)16)23-19(31)25-21(27)29-4-2/h5-8,10-11H,3-4,9H2,1-2H3,(H2,22,24,26,30)(H2,23,25,27,31)
InChIKey	TYKQOVFHUYMSKF-UHFFFAOYSA-N
Molecular Weight	458.551 g/mol
SMILES	N(C(Nc1cc2Cc3cc(NC(NC(=O)OCC)=S)ccc3-c2cc1)=S)C(=O)OCC
SPLASH	splash10-004i-0009100000-420449402c67803dd933
Source of Spectrum	AF-48-5485-10a
Wiley ID	1713934