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4-(2-((2-Phenoxyethyl)thio)-1H-benzo[d]imidazol-1-yl)-1-(pyrrolidin-1-yl)butan-1-one
SpectraBase Compound ID KjFzl3uwE0O
InChI InChI=1S/C23H27N3O2S/c27-22(25-14-6-7-15-25)13-8-16-26-21-12-5-4-11-20(21)24-23(26)29-18-17-28-19-9-2-1-3-10-19/h1-5,9-12H,6-8,13-18H2
InChIKey ZXNPVDOMPCBEFA-UHFFFAOYSA-N
Mol Weight 409.55 g/mol
Molecular Formula C23H27N3O2S
Exact Mass 409.182398 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1kARmA0qxjq
Name 4-(2-((2-Phenoxyethyl)thio)-1H-benzo[d]imidazol-1-yl)-1-(pyrrolidin-1-yl)butan-1-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H27N3O2S
InChI InChI=1S/C23H27N3O2S/c27-22(25-14-6-7-15-25)13-8-16-26-21-12-5-4-11-20(21)24-23(26)29-18-17-28-19-9-2-1-3-10-19/h1-5,9-12H,6-8,13-18H2
InChIKey ZXNPVDOMPCBEFA-UHFFFAOYSA-N
Molecular Weight 409.548 g/mol
SMILES C(CCC[n]1c(nc2c1cccc2)SCCOc1ccccc1)(=O)N1CCCC1
SPLASH splash10-000l-0940100000-ce26e16d8de45fa7b54e
Source of Spectrum RSA-6-39573/SM28-17c
Wiley ID 1807174