SpectraBase Spectrum ID |
1LQqaabYhbJ |
Name |
S-[2-[[[2-(dimethylcarbamoylsulfanyl)phenyl]methyl-(2-thienylmethyl)amino]methyl]phenyl] N,N-dimethylcarbamothioate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C25H29N3O2S3 |
InChI |
InChI=1S/C25H29N3O2S3/c1-26(2)24(29)32-22-13-7-5-10-19(22)16-28(18-21-12-9-15-31-21)17-20-11-6-8-14-23(20)33-25(30)27(3)4/h5-15H,16-18H2,1-4H3 |
InChIKey |
MKTAWKCVAYZQQL-UHFFFAOYSA-N |
Instrument Name |
Shimadzu GCMS-QP 2010 |
Ionization Type |
EI |
Literature Reference DOI |
10.1002/ejic.202100105 |
Molecular Weight |
499.706 g/mol |
SMILES |
c1(CN(Cc2sccc2)Cc2c(cccc2)SC(N(C)C)=O)ccccc1SC(N(C)C)=O |
SPLASH |
splash10-00dj-9403000000-e5d8ed278d596dedc4a5 |
Source of Spectrum |
U2-2021-SM10-L2a |
Wiley ID |
1851871 |