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N-(4-methoxyphenyl)-2-(2-thienylsulfonyl)-3,4-dihydro-1H-isoquinoline-3-carboxamide
SpectraBase Compound ID GlpueLeMi6d
InChI InChI=1S/C21H20N2O4S2/c1-27-18-10-8-17(9-11-18)22-21(24)19-13-15-5-2-3-6-16(15)14-23(19)29(25,26)20-7-4-12-28-20/h2-12,19H,13-14H2,1H3,(H,22,24)
InChIKey ZTMLXHKKPRZFDP-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 7NBXxuCxYfv
Name N-(4-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/c1-27-18-10-8-17(9-11-18)22-21(24)19-13-15-5-2-3-6-16(15)14-23(19)29(25,26)20-7-4-12-28-20/h2-12,19H,13-14H2,1H3,(H,22,24)
InChIKey ZTMLXHKKPRZFDP-UHFFFAOYSA-N
Molecular Weight 428.521 g/mol
SMILES N(C(C1Cc2ccccc2CN1S(c1sccc1)(=O)=O)=O)c1ccc(cc1)OC
SPLASH splash10-001i-5920000000-0b5a8b154b3a362ef4e0
Synonyms N-(4-methoxyphenyl)-2-thiophen-2-ylsulfonyl-3,4-dihydro-1H-isoquinoline-3-carboxamide
Wiley ID 1445376