SpectraBase Spectrum ID |
BnddR01RQah |
Name |
1-(3-CYANO-4,5,6,7-TETRAHYDRO-2-BENZO[b]THIENYL)-3-(3,4- |
Copyright |
Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
Formula |
C21H21N3O3S2 |
InChI |
InChI=1S/C21H21N3O3S2/c1-26-16-9-7-13(11-17(16)27-2)8-10-19(25)23-21(28)24-20-15(12-22)14-5-3-4-6-18(14)29-20/h7-11H,3-6H2,1-2H3,(H2,23,24,25,28)/b10-8+ |
InChIKey |
UJFCSWMLTAAESH-CSKARUKUSA-N |
Molecular Weight |
427.1020 |
SMILES |
N(C(=S)NC(\C=C\c1ccc(OC)c(OC)c1)=O)c1sc2CCCCc2c1C#N |
SPLASH |
splash10-0006-9510000000-d79ceac3f6d98492d29f |
Source of Spectrum |
Chemical Concepts, A Wiley Division, Weinheim, Germany |