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2-Benzamido-N-(2-morpholin-4-ylethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide

View entire compound with spectra: 1 NMR, and 1 MS (GC)

2-Benzamido-N-(2-morpholin-4-ylethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
SpectraBase Compound ID GJViL61avGr
InChI InChI=1S/C22H27N3O3S/c26-20(16-6-2-1-3-7-16)24-22-19(17-8-4-5-9-18(17)29-22)21(27)23-10-11-25-12-14-28-15-13-25/h1-3,6-7H,4-5,8-15H2,(H,23,27)(H,24,26)
InChIKey IKGFXTWOIGVZAI-UHFFFAOYSA-N
Mol Weight 413.54 g/mol
Molecular Formula C22H27N3O3S
Exact Mass 413.177313 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2qKMoJ5MAB2
Name 2-Benzamido-N-(2-morpholin-4-ylethyl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 413.177312912 u
Formula C22H27N3O3S
InChI InChI=1S/C22H27N3O3S/c26-20(16-6-2-1-3-7-16)24-22-19(17-8-4-5-9-18(17)29-22)21(27)23-10-11-25-12-14-28-15-13-25/h1-3,6-7H,4-5,8-15H2,(H,23,27)(H,24,26)
InChIKey IKGFXTWOIGVZAI-UHFFFAOYSA-N
Molecular Weight 413.536 g/mol
SMILES C1(=C(C=2CCCCC2S1)C(=O)NCCN1CCOCC1)NC(=O)C1=CC=CC=C1