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N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(phenylsulfamoyl)benzamide
SpectraBase Compound ID Lj1ac0wtu8k
InChI InChI=1S/C23H21N3O3S2/c1-15-10-11-19-20(14-24)23(30-21(19)12-15)25-22(27)16-6-5-9-18(13-16)31(28,29)26-17-7-3-2-4-8-17/h2-9,13,15,26H,10-12H2,1H3,(H,25,27)
InChIKey YPQKSZMZVLCNNP-UHFFFAOYSA-N
Mol Weight 451.56 g/mol
Molecular Formula C23H21N3O3S2
Exact Mass 451.102434 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BvIxI9iXzGt
Name N-(3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)-3-(phenylsulfamoyl)benzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H21N3O3S2
InChI InChI=1S/C23H21N3O3S2/c1-15-10-11-19-20(14-24)23(30-21(19)12-15)25-22(27)16-6-5-9-18(13-16)31(28,29)26-17-7-3-2-4-8-17/h2-9,13,15,26H,10-12H2,1H3,(H,25,27)
InChIKey YPQKSZMZVLCNNP-UHFFFAOYSA-N
Molecular Weight 451.559 g/mol
SMILES N(c1c(c2CCC(Cc2s1)C)C#N)C(c1cc(S(Nc2ccccc2)(=O)=O)ccc1)=O
SPLASH splash10-03di-2590000000-8dec7ecb1df7e4090f5e
Synonyms N-(3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)-3-(phenylsulfamoyl)benzamide
Wiley ID 1442158