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N-(2-methoxyphenyl)-2-(2-thienylsulfonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide
SpectraBase Compound ID DTM44AHPTat
InChI InChI=1S/C21H20N2O4S2/c1-27-19-10-5-4-9-17(19)22-21(24)18-13-15-7-2-3-8-16(15)14-23(18)29(25,26)20-11-6-12-28-20/h2-12,18H,13-14H2,1H3,(H,22,24)
InChIKey ISWCTMBNROBZQV-UHFFFAOYSA-N
Mol Weight 428.52 g/mol
Molecular Formula C21H20N2O4S2
Exact Mass 428.086449 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 50dTTaH9baQ
Name N-(2-methoxyphenyl)-2-(2-thienylsulfonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H20N2O4S2
InChI InChI=1S/C21H20N2O4S2/c1-27-19-10-5-4-9-17(19)22-21(24)18-13-15-7-2-3-8-16(15)14-23(18)29(25,26)20-11-6-12-28-20/h2-12,18H,13-14H2,1H3,(H,22,24)
InChIKey ISWCTMBNROBZQV-UHFFFAOYSA-N
Molecular Weight 428.521 g/mol
SMILES N(C(C1Cc2ccccc2CN1S(c1sccc1)(=O)=O)=O)c1ccccc1OC
SPLASH splash10-001i-5930000000-abb4d26b7efa03676dd0
Synonyms N-(2-methoxyphenyl)-2-thiophen-2-ylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
Wiley ID 1445375