SpectraBase Compound ID | Ds2fV2jzT9C |
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InChI | InChI=1S/C19H16ClF6N3O2S/c20-10-5-3-4-9(8-10)15(31)28-17(18(21,22)23,19(24,25)26)29-16-13(14(27)30)11-6-1-2-7-12(11)32-16/h3-5,8,29H,1-2,6-7H2,(H2,27,30)(H,28,31) |
InChIKey | YTLILPFXMGWRJP-UHFFFAOYSA-N |
Mol Weight | 499.86 g/mol |
Molecular Formula | C19H16ClF6N3O2S |
Exact Mass | 499.055595 g/mol |
SpectraBase Spectrum ID | F9TPMlu8wie |
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Name | 2-([1-[(3-Chlorobenzoyl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]amino)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide |
CAS Registry Number | 309731-52-0 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C19H16ClF6N3O2S |
InChI | InChI=1S/C19H16ClF6N3O2S/c20-10-5-3-4-9(8-10)15(31)28-17(18(21,22)23,19(24,25)26)29-16-13(14(27)30)11-6-1-2-7-12(11)32-16/h3-5,8,29H,1-2,6-7H2,(H2,27,30)(H,28,31) |
InChIKey | YTLILPFXMGWRJP-UHFFFAOYSA-N |
Molecular Weight | 499.859 g/mol |
SMILES | N(c1c(C(=O)N)c2CCCCc2s1)C(NC(c1cc(Cl)ccc1)=O)(C(F)(F)F)C(F)(F)F |
SPLASH | splash10-01rl-6932000000-58c7b2fa83108448407a |
Source of Spectrum | AD-0-2532-0 |
Synonyms | 2-[[1-[(3-chlorobenzoyl)amino]-2,2,2-trifluoro-1-(trifluoromethyl)ethyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide 2-[[2-[(3-chlorobenzoyl)amino]-1,1,1,3,3,3-hexafluoropropan-2-yl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide 2-[[2-[(3-chlorophenyl)carbonylamino]-1,1,1,3,3,3-hexakis(fluoranyl)propan-2-yl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide 2-[[2-[[(3-chlorophenyl)-oxomethyl]amino]-1,1,1,3,3,3-hexafluoropropan-2-yl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide Benzothiophene-3-carboxamide, 4,5,6,7-tetrahydro-2-[1-(3-chlorobenzoylamino)-2,2,2-trifluoro-1-trifluoromethylethylamino]- |
Wiley ID | 1429799 |