p-[3-(p-methoxyphenyl)-2-thioureido]benzoic acid, ethyl ester

SpectraBase Compound ID	DdSo5czPmpZ
InChI	InChI=1S/C17H18N2O3S/c1-3-22-16(20)12-4-6-13(7-5-12)18-17(23)19-14-8-10-15(21-2)11-9-14/h4-11H,3H2,1-2H3,(H2,18,19,23)
InChIKey	WTCWMMUBLZKBQQ-UHFFFAOYSA-N Google Search
Mol Weight	330.4 g/mol
Molecular Formula	C17H18N2O3S
Exact Mass	330.103814 g/mol

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SpectraBase Spectrum ID	45ZtSdpqls
Name	Ethyl 4-([(4-methoxyanilino)carbothioyl]amino)benzoate
Alternate Name(s)	4-[(4-methoxyphenyl)thiocarbamoylamino]benzoic acid ethyl ester 4-[[(4-methoxyanilino)-sulfanylidenemethyl]amino]benzoic acid ethyl ester Ethyl 4-[(4-methoxyphenyl)carbamothioylamino]benzoate
CAS Registry Number	1164-21-2
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C17H18N2O3S
InChI	InChI=1S/C17H18N2O3S/c1-3-22-16(20)12-4-6-13(7-5-12)18-17(23)19-14-8-10-15(21-2)11-9-14/h4-11H,3H2,1-2H3,(H2,18,19,23)
InChIKey	WTCWMMUBLZKBQQ-UHFFFAOYSA-N
Molecular Weight	330.402 g/mol
SMILES	N(C(Nc1ccc(C(=O)OCC)cc1)=S)c1ccc(cc1)OC
SPLASH	splash10-074i-3910000000-876cbd2532e434b993a5
Source of Spectrum	AD-0-2532-0
Wiley ID	1433106