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N-Phenyl-2-[(5',6',7',8'-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2'-yl)thio]-3-oxobutamide
SpectraBase Compound ID Kx8OFUmg5Xc
InChI InChI=1S/C20H19N3O3S2/c24-13(10-16(25)21-12-6-2-1-3-7-12)11-27-20-22-18(26)17-14-8-4-5-9-15(14)28-19(17)23-20/h1-3,6-7H,4-5,8-11H2,(H,21,25)(H,22,23,26)
InChIKey CDLGXYUJMVDUQT-UHFFFAOYSA-N
Mol Weight 413.51 g/mol
Molecular Formula C20H19N3O3S2
Exact Mass 413.086784 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 89OybdWNR8g
Name N-Phenyl-2-[(5',6',7',8'-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-2'-yl)thio]-3-oxobutamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19N3O3S2
InChI InChI=1S/C20H19N3O3S2/c24-13(10-16(25)21-12-6-2-1-3-7-12)11-27-20-22-18(26)17-14-8-4-5-9-15(14)28-19(17)23-20/h1-3,6-7H,4-5,8-11H2,(H,21,25)(H,22,23,26)
InChIKey CDLGXYUJMVDUQT-UHFFFAOYSA-N
Molecular Weight 413.510 g/mol
SMILES N1C(c2c(N=C1SCC(CC(Nc1ccccc1)=O)=O)sc1CCCCc21)=O
SPLASH splash10-00fr-1908000000-0e14ea21f518ce610e78
Source of Spectrum AH-140-219-11c
Wiley ID 1696030