For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[(5-ethoxy-1H-benzimidazol-2-yl)sulfanyl]acetamide
SpectraBase Compound ID AnfaCDRQUA0
InChI InChI=1S/C20H19N3O5S/c1-3-26-12-4-5-14-16(6-12)23-20(22-14)29-9-19(25)21-15-8-18-17(27-10-28-18)7-13(15)11(2)24/h4-8H,3,9-10H2,1-2H3,(H,21,25)(H,22,23)
InChIKey RZFKQXFXLJCRHF-UHFFFAOYSA-N
Mol Weight 413.45 g/mol
Molecular Formula C20H19N3O5S
Exact Mass 413.104542 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 8DVnsE6Q9QU
Name N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[(5-ethoxy-1H-benzimidazol-2-yl)sulfanyl]acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H19N3O5S
InChI InChI=1S/C20H19N3O5S/c1-3-26-12-4-5-14-16(6-12)23-20(22-14)29-9-19(25)21-15-8-18-17(27-10-28-18)7-13(15)11(2)24/h4-8H,3,9-10H2,1-2H3,(H,21,25)(H,22,23)
InChIKey RZFKQXFXLJCRHF-UHFFFAOYSA-N
Molecular Weight 413.448 g/mol
SMILES [nH]1c2ccc(cc2nc1SCC(Nc1c(cc2OCOc2c1)C(=O)C)=O)OCC
SPLASH splash10-004i-2910000000-c73c70a400083083f905
Synonyms N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]acetamide N-(6-acetyl-1,3-benzodioxol-5-yl)-2-[(6-ethoxy-1H-benzimidazol-2-yl)thio]acetamide N-(6-ethanoyl-1,3-benzodioxol-5-yl)-2-[(6-ethoxy-1H-benzimidazol-2-yl)sulfanyl]ethanamide
Wiley ID 1443129