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6-Methyl-N-o-phenetyl-2-(o-toluoylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide
SpectraBase Compound ID 4oyVScRuubA
InChI InChI=1S/C26H28N2O3S/c1-4-31-21-12-8-7-11-20(21)27-25(30)23-19-14-13-16(2)15-22(19)32-26(23)28-24(29)18-10-6-5-9-17(18)3/h5-12,16H,4,13-15H2,1-3H3,(H,27,30)(H,28,29)
InChIKey MKKFGVIWGVCBGI-UHFFFAOYSA-N
Mol Weight 448.58 g/mol
Molecular Formula C26H28N2O3S
Exact Mass 448.182064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KX5VjcA0Tpj
Name 6-Methyl-N-o-phenetyl-2-(o-toluoylamino)-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide
Alternate Name(s) N-(2-ethoxyphenyl)-6-methyl-2-[(2-methylbenzoyl)amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide N-(2-ethoxyphenyl)-6-methyl-2-[(2-methylbenzoyl)amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxamide N-(2-ethoxyphenyl)-6-methyl-2-[(2-methylphenyl)carbonylamino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide N-(2-ethoxyphenyl)-6-methyl-2-[[(2-methylphenyl)-oxomethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
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Formula C26H28N2O3S
InChI InChI=1S/C26H28N2O3S/c1-4-31-21-12-8-7-11-20(21)27-25(30)23-19-14-13-16(2)15-22(19)32-26(23)28-24(29)18-10-6-5-9-17(18)3/h5-12,16H,4,13-15H2,1-3H3,(H,27,30)(H,28,29)
InChIKey MKKFGVIWGVCBGI-UHFFFAOYSA-N
Molecular Weight 448.581 g/mol
SMILES N(c1c(C(Nc2c(OCC)cccc2)=O)c2c(s1)CC(CC2)C)C(c1c(C)cccc1)=O
SPLASH splash10-00kr-2901200000-42500ac2776402911e0f
Wiley ID 1454510