SpectraBase Spectrum ID |
IST6NjWF9cD |
Name |
4-(4-Bromophenyl)-8-(4-bromophenyl)methylene-6-ethyl-1,2,3,4,7,8-hexahydro-5H-pyrido[4,3-d]pyrimidine-2-thione |
Comments |
Less than 3 mono-isotopic peaks |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C22H21Br2N3S |
InChI |
InChI=1S/C22H21Br2N3S/c1-2-27-12-16(11-14-3-7-17(23)8-4-14)21-19(13-27)20(25-22(28)26-21)15-5-9-18(24)10-6-15/h3-11,20H,2,12-13H2,1H3,(H2,25,26,28)/b16-11- |
InChIKey |
CHJRNYVCAQDOMV-WJDWOHSUSA-N |
Molecular Weight |
519.299 g/mol |
SMILES |
N1C2=C(C(NC1=S)c1ccc(cc1)Br)CN(C\C2=C/c1ccc(cc1)Br)CC |
SPLASH |
splash10-014i-0000090000-099a864e855e34113371 |
Source of Spectrum |
Y1-40-213-3 |
Synonyms |
(8Z)-8-(4-bromobenzylidene)-4-(4-bromophenyl)-6-ethyl-3,4,5,6,7,8-hexahydropyrido[4,3-d]pyrimidine-2(1H)-thione |
Wiley ID |
1528129 |