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Ethyl 2-(3-(naphthalen-2-yl)thioureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
SpectraBase Compound ID 3cCV1vKCsH7
InChI InChI=1S/C22H22N2O2S2/c1-2-26-21(25)19-17-9-5-6-10-18(17)28-20(19)24-22(27)23-16-12-11-14-7-3-4-8-15(14)13-16/h3-4,7-8,11-13H,2,5-6,9-10H2,1H3,(H2,23,24,27)
InChIKey SPADDNTWJNKDNW-UHFFFAOYSA-N
Mol Weight 410.55 g/mol
Molecular Formula C22H22N2O2S2
Exact Mass 410.11227 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FY4DtkgXJbM
Name Ethyl 2-(3-(naphthalen-2-yl)thioureido)-4,5,6,7-tetrahydrobenzo[b]thiophene-3-carboxylate
Alternate Name(s) 2-[[(2-naphthalenylamino)-sulfanylidenemethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester Ethyl 2-(2-naphthylcarbamothioylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate Ethyl 2-(naphthalen-2-ylcarbamothioylamino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H22N2O2S2
InChI InChI=1S/C22H22N2O2S2/c1-2-26-21(25)19-17-9-5-6-10-18(17)28-20(19)24-22(27)23-16-12-11-14-7-3-4-8-15(14)13-16/h3-4,7-8,11-13H,2,5-6,9-10H2,1H3,(H2,23,24,27)
InChIKey SPADDNTWJNKDNW-UHFFFAOYSA-N
Molecular Weight 410.550 g/mol
SMILES N(c1c(c2CCCCc2s1)C(=O)OCC)C(Nc1cc2ccccc2cc1)=S
SPLASH splash10-004i-0940200000-453fac744ac97e2bc7ee
Source of Spectrum Y-51-1392-3fc
Wiley ID 1741558