SpectraBase Spectrum ID |
XmFfLZ71oZ |
Name |
4-Pyridinecarboxamide, N-[5-[2-[(4-ethoxyphenyl)amino]-2-oxoethyl]-3-ethyl-4-oxo-2-thioxo-1-imidazolidinyl]- |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
441.147075411 u |
Formula |
C21H23N5O4S |
InChI |
InChI=1S/C21H23N5O4S/c1-3-25-20(29)17(13-18(27)23-15-5-7-16(8-6-15)30-4-2)26(21(25)31)24-19(28)14-9-11-22-12-10-14/h5-12,17H,3-4,13H2,1-2H3,(H,23,27)(H,24,28) |
InChIKey |
KUYMNIDHISUDHU-UHFFFAOYSA-N |
Molecular Weight |
441.506 g/mol |
SMILES |
N(C(CC1C(N(C(N1NC(=O)C=1C=CN=CC1)=S)CC)=O)=O)C=1C=CC(=CC1)OCC |