SpectraBase Spectrum ID |
IZGjlpLmVxG |
Name |
N-Benzoyl-N'-[3-cyano-6-(2-phenylethyl)-4,5,6,7-tetrahydrothieno[2,3-C]pyridin-2-yl]thiourea |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
446.123503691 u |
Formula |
C24H22N4OS2 |
InChI |
InChI=1S/C24H22N4OS2/c25-15-20-19-12-14-28(13-11-17-7-3-1-4-8-17)16-21(19)31-23(20)27-24(30)26-22(29)18-9-5-2-6-10-18/h1-10H,11-14,16H2,(H2,26,27,29,30) |
InChIKey |
GJGIORQFSOWFRW-UHFFFAOYSA-N |
Molecular Weight |
446.587 g/mol |
SMILES |
N(C1=C(C=2CCN(CC2S1)CCC=1C=CC=CC1)C#N)C(NC(=O)C=1C=CC=CC1)=S |