SpectraBase Spectrum ID |
1YlMGFC8WEi |
Name |
[4-(4-Acetamido-2-diethylamino-5-thiazolyl)-5-(4-diethylamino-2,6-dimethylphenyl)imino-2,5-dihydro-2-thiazolylidene]diethylammonium tetrafluoroborate |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C28H42BF4N7OS2 |
InChI |
InChI=1S/C28H41N7OS2.BF4/c1-10-33(11-2)21-16-18(7)22(19(8)17-21)30-26-23(31-27(38-26)34(12-3)13-4)24-25(29-20(9)36)32-28(37-24)35(14-5)15-6;2-1(3,4)5/h16-17H,10-15H2,1-9H3;/q;-1/p+1/b30-26-; |
InChIKey |
ZMWWTEXYPYOQKZ-AFCPYBGBSA-O |
Molecular Weight |
643.616 g/mol |
SMILES |
[B-](F)(F)(F)F.N(c1nc(sc1C1=NC(=[N+](CC)CC)S\C1=N\c1c(cc(cc1C)N(CC)CC)C)N(CC)CC)C(=O)C |
SPLASH |
splash10-0bvi-0000090000-508ad50d0c4f7f70fb83 |
Source of Spectrum |
AJ-75-579-3 |
Synonyms |
(5Z)-5-{[4-(diethylamino)-2,6-dimethylphenyl]imino}-4-[2-(diethylamino)-4-acetamido-1,3-thiazol-5-yl]-N,N-diethyl-2,5-dihydro-1,3-thiazol-2-iminium; tetrafluoroboranuide |
Wiley ID |
1577006 |