SpectraBase Spectrum ID |
CPbGW2TqXBH |
Name |
Ethyl 5-benzyl-2-[(4-morpholinylcarbothioyl)amino]-3-thiophenecarboxylate |
Comments |
Computed using HOSE algorithm |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
390.107184921 u |
Formula |
C19H22N2O3S2 |
InChI |
InChI=1S/C19H22N2O3S2/c1-2-24-18(22)16-13-15(12-14-6-4-3-5-7-14)26-17(16)20-19(25)21-8-10-23-11-9-21/h3-7,13H,2,8-12H2,1H3,(H,20,25) |
InChIKey |
XICIBGUKVHDRMT-UHFFFAOYSA-N |
Molecular Weight |
390.516 g/mol |
SMILES |
N(C1=C(C=C(S1)CC1=CC=CC=C1)C(=O)OCC)C(N1CCOCC1)=S |