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N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-[(3-nitrophenyl)sulfamoyl]benzamide
SpectraBase Compound ID 4mYQIN5AgYN
InChI InChI=1S/C23H20N4O5S2/c1-14-8-9-19-20(13-24)23(33-21(19)10-14)25-22(28)15-4-2-7-18(11-15)34(31,32)26-16-5-3-6-17(12-16)27(29)30/h2-7,11-12,14,26H,8-10H2,1H3,(H,25,28)
InChIKey ZALBVFCZWMGWPC-UHFFFAOYSA-N
Mol Weight 496.56 g/mol
Molecular Formula C23H20N4O5S2
Exact Mass 496.087512 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IkPcHlOqqgV
Name N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-[(3-nitrophenyl)sulfamoyl]benzamide
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Formula C23H20N4O5S2
InChI InChI=1S/C23H20N4O5S2/c1-14-8-9-19-20(13-24)23(33-21(19)10-14)25-22(28)15-4-2-7-18(11-15)34(31,32)26-16-5-3-6-17(12-16)27(29)30/h2-7,11-12,14,26H,8-10H2,1H3,(H,25,28)
InChIKey ZALBVFCZWMGWPC-UHFFFAOYSA-N
Molecular Weight 496.556 g/mol
SMILES N(c1c(c2CCC(Cc2s1)C)C#N)C(c1cc(S(Nc2cc(N(=O)=O)ccc2)(=O)=O)ccc1)=O
SPLASH splash10-0a4i-4927000000-ef74cd4efc0823b3eb8f
Synonyms N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-[(3-nitrophenyl)sulfamoyl]benzamide
Wiley ID 1442160