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butanamide, N-[3-(1H-benzimidazol-2-yl)-4,5-dimethyl-1-[3-(1-methylethoxy)propyl]-1H-pyrrol-2-yl]-3-methyl-
SpectraBase Compound ID GThYhaZjdLS
InChI InChI=1S/C24H34N4O2/c1-15(2)14-21(29)27-24-22(23-25-19-10-7-8-11-20(19)26-23)17(5)18(6)28(24)12-9-13-30-16(3)4/h7-8,10-11,15-16H,9,12-14H2,1-6H3,(H,25,26)(H,27,29)
InChIKey PWBFJGOGTJFBHR-UHFFFAOYSA-N
Mol Weight 410.6 g/mol
Molecular Formula C24H34N4O2
Exact Mass 410.268176 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LTJzQdFFwSD
Name Butanamide, N-[3-(1H-benzimidazol-2-yl)-4,5-dimethyl-1-[3-(1-methylethoxy)propyl]-1H-pyrrol-2-yl]-3-methyl-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 410.268176349 u
Formula C24H34N4O2
InChI InChI=1S/C24H34N4O2/c1-15(2)14-21(29)27-24-22(23-25-19-10-7-8-11-20(19)26-23)17(5)18(6)28(24)12-9-13-30-16(3)4/h7-8,10-11,15-16H,9,12-14H2,1-6H3,(H,25,26)(H,27,29)
InChIKey PWBFJGOGTJFBHR-UHFFFAOYSA-N
Molecular Weight 410.562 g/mol
SMILES N(C1=C(C2=NC=3C=CC=CC3N2)C(=C(N1CCCOC(C)C)C)C)C(=O)CC(C)C