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N-[3-(4-ethylpiperazin-1-yl)carbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]thiophene-2-carboxamide
SpectraBase Compound ID DgjRmyvwPWd
InChI InChI=1S/C20H25N3O2S2/c1-2-22-9-11-23(12-10-22)20(25)17-14-6-3-4-7-15(14)27-19(17)21-18(24)16-8-5-13-26-16/h5,8,13H,2-4,6-7,9-12H2,1H3,(H,21,24)
InChIKey NUENWGVGWHPQHZ-UHFFFAOYSA-N
Mol Weight 403.56 g/mol
Molecular Formula C20H25N3O2S2
Exact Mass 403.138819 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3XUeAdmWeW
Name N-[3-(4-ethylpiperazin-1-yl)carbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]thiophene-2-carboxamide
Alternate Name(s) N-[3-(4-ethylpiperazine-1-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]thiophene-2-carboxamide N-[3-(4-ethylpiperazine-1-carbonyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]thiophene-2-carboxamide N-[3-[(4-ethyl-1-piperazinyl)-oxomethyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-thiophenecarboxamide
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Formula C20H25N3O2S2
InChI InChI=1S/C20H25N3O2S2/c1-2-22-9-11-23(12-10-22)20(25)17-14-6-3-4-7-15(14)27-19(17)21-18(24)16-8-5-13-26-16/h5,8,13H,2-4,6-7,9-12H2,1H3,(H,21,24)
InChIKey NUENWGVGWHPQHZ-UHFFFAOYSA-N
Molecular Weight 403.559 g/mol
SMILES N(c1c(C(N2CCN(CC2)CC)=O)c2c(CCCC2)s1)C(c1sccc1)=O
SPLASH splash10-03e9-9530100000-7570f8043f761aac4121
Wiley ID 1461430