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Benzothiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-2-[1-(2,4-dichlorobenzoylamino)-2,2,2-trifluoro-1-methoxycarbonylethylamino]-, methyl ester

View entire compound with spectra: 1 MS (GC)

Benzothiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-2-[1-(2,4-dichlorobenzoylamino)-2,2,2-trifluoro-1-methoxycarbonylethylamino]-, methyl ester
SpectraBase Compound ID F4WncxWN7vf
InChI InChI=1S/C21H19Cl2F3N2O5S/c1-32-18(30)15-12-5-3-4-6-14(12)34-17(15)28-20(19(31)33-2,21(24,25)26)27-16(29)11-8-7-10(22)9-13(11)23/h7-9,28H,3-6H2,1-2H3,(H,27,29)
InChIKey DTUFOCOHNVUADZ-UHFFFAOYSA-N
Mol Weight 539.35 g/mol
Molecular Formula C21H19Cl2F3N2O5S
Exact Mass 538.034383 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7GTW1tzarsE
Name Benzothiophene-3-carboxylic acid, 4,5,6,7-tetrahydro-2-[1-(2,4-dichlorobenzoylamino)-2,2,2-trifluoro-1-methoxycarbonylethylamino]-, methyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H19Cl2F3N2O5S
InChI InChI=1S/C21H19Cl2F3N2O5S/c1-32-18(30)15-12-5-3-4-6-14(12)34-17(15)28-20(19(31)33-2,21(24,25)26)27-16(29)11-8-7-10(22)9-13(11)23/h7-9,28H,3-6H2,1-2H3,(H,27,29)
InChIKey DTUFOCOHNVUADZ-UHFFFAOYSA-N
Molecular Weight 539.353 g/mol
SMILES N(c1c(c2CCCCc2s1)C(=O)OC)C(NC(c1c(cc(cc1)Cl)Cl)=O)(C(F)(F)F)C(=O)OC
SPLASH splash10-00fr-3920000000-5ac23613df0e85cfa271
Source of Spectrum AD-0-2532-0
Synonyms 2-[[1-carbomethoxy-1-[(2,4-dichlorobenzoyl)amino]-2,2,2-trifluoro-ethyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester 2-[[2-[[(2,4-dichlorophenyl)-oxomethyl]amino]-1,1,1-trifluoro-3-methoxy-3-oxopropan-2-yl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester Methyl 2-([1-[(2,4-dichlorobenzoyl)amino]-2,2,2-trifluoro-1-(methoxycarbonyl)ethyl]amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Methyl 2-[[1-[(2,4-dichlorobenzoyl)amino]-2,2,2-trifluoro-1-methoxycarbonyl-ethyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate Methyl 2-[[2-[(2,4-dichlorobenzoyl)amino]-1,1,1-trifluoro-3-methoxy-3-oxopropan-2-yl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Methyl 2-[[2-[(2,4-dichlorophenyl)carbonylamino]-1,1,1-tris(fluoranyl)-3-methoxy-3-oxidanylidene-propan-2-yl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate
Wiley ID 1419055